Rimantadine

HCID 5071

Basic information

CAS
117857-51-9
Standard SMILES
CC(N)C12CC3CC(CC(C3)C1)C2
InChIKey
UBCHPRBFMUDMNC-UHFFFAOYSA-N
Molecular formula
C12H21N
Average molar mass
179.3 g/mol
Monoisotopic mass
179.16739967

Overview

1-(1-adamantyl)ethanamine is an alkylamine.

Names & identifiers

Preferred name
Rimantadine
IUPAC
1-(1-adamantyl)ethanamine
English name
1-AdaMantanethylaMine
Molecular formula
C12H21N
Molecular weight
179.3

Names & synonyms

rimantadine13392-28-4RimantadinaRemantadineRimantadinum1-(adamantan-1-yl)ethan-1-amineRiamantadine1-(1-Adamantyl)ethylaminalpha-Methyl-1-adamantanemethylaminealpha-MethyladamantanemethylamineHSDB 74380T2EF4JQTU
Show more names
LEVOFLOXACIN HCL1-AdamantanemethylamineRiMantidineRiMantadine (FluMadine)Levofloxacine Hydrochloride1-AdamanAKOS B0222661-RimantadineAKOS NCG1-0034
DTXSID2023561Tricyclo(3.3.1.1(sup 3,7))decane-1-methanamine, alpha-methyl-Tricyclo(3.3.1.13,7)decane-1-methanamine, alpha-methyl-J05AC02RefChem:55982DTXCID5035611-(1-Adamantyl)ethanamine1-(Adamantan-1-yl)ethanamine

Database identifiers

CAS
117857-51-9、13392-28-4
PubChem CID
5071
DTXSID
DTXSID2023561
ChEMBL
CHEMBL1201272、CHEMBL959
ChEBI
CHEBI:94440
UNII
0T2EF4JQTU
Nikkaji
J8.105A

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
26 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
13

Experimental & physicochemical properties

LogP3.6
Solubility · 2 items

Hydrochloride salt freely soluble (50 mg/ml at 20 °C)

9.15e-03 g/L

Human DrugsBreast Feeding; Lactation; Antiviral Agents; Nucleic Acid Synthesis Inhibitors
Melting Point · 2 items

>300 °C

> 300 °C

Physical DescriptionSolid
Collision Cross Section145.1 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

Physicochemical properties

Boiling point
248 °C · 248°C
Density
1.033 · 1.033
Flash point
99 °C · 99°C
storage temp.
-20 °C · Store at -20°C
solubility
Soluble in DMSO
form
Liquid

Safety & regulation

Hazard information

FDA Requirements · 1 item

The Approved Drug Products with Therapeutic Equivalence Evaluations List identifies currently marketed prescription drug products, incl rimantadine, approved on the basis of safety and effectiveness by FDA under sections 505 of the Federal Food, Drug, and Cosmetic Act.

Safety & protection

Storage ConditionsCommercially available rimantadine hydrochloride tablets and oral solution should be stored in tight, light-resistant containers at 15-30 °C.
Disposal Methods · 1 item

SRP: The most favorable course of action is to use an alternative chemical product with less inherent propensity for occupational exposure or environmental contamination. Recycle any unused portion of the material for its approved use or return it to the manufacturer or supplier. Ultimate disposal of the chemical must consider: the material's impact on air quality; potential migration in soil or water; effects on animal, aquatic, and plant life; and conformance with environmental and public health regulations.

Toxicology

Interactions · 3 items

Concurrent use of a single dose of rimantadine with cimetidine reduces rimantadine clearance by 18% in healthy adults; the clinical significance si thought to be minimal at this time.

Because influenza antiviral agents reduce replication of influenza viruses, do not administer influenza virus vaccine live intranasal until at least 48 hours after rimantadine is discontinued and do not administer rimantadine until at least 2 weeks after administration of influenza virus vaccine live intranasal. Cimetidine

Concurrent use of acetaminophen or aspirin with rimantadine reduces the peak serum concentration of rimantadine by approximately 11%; the clinical significance is thought to be minimal at this time.

HepatotoxicityDespite widespread use, there is little evidence that rimantadine when given orally causes liver injury, either in the form of serum enzyme elevations or clinically apparent liver disease.
Milk ConcentrationsIt is not known whether rimantadine is distributed into breast milk. However, it is distributed into the milk of rats. Rimantadine concentrations in the milk of rats were twice those found in serum 2 to 3 hours after administration.
Drug Induced Liver Injury · 5 items

Drug-Induced Liver Injury Severity and Toxicity (DILIst)

rimantadine

DILI Negative

Oral

DOI:10.1016/j.drudis.2019.09.022

Non-Human Toxicity Excerpts · 5 items

/LABORATORY ANIMALS: Developmental or Reproductive Toxicity/ A study in male and female rats given doses of up to 60 mg/kg of body weight per day showed no impairment of fertility.

/LABORATORY ANIMALS: Developmental or Reproductive Toxicity/ It has been shown to be embryotoxic in rats when given at a dose of 200 mg/kg/day, and has caused fetal resorption. Maternal toxicity included ataxia, tremors, seizures, and significantly reduced weight gain.

/LABORATORY ANIMALS: Developmental or Reproductive Toxicity/ Rimantadine was not embryotoxic when given to rabbits in doses of up to 50 mg/kg/day. However, there was evidence of a change in the ratio of fetuses with 12 ribs to fetuses with 13 ribs; normally the ratio is 50:50 in a litter, but the ratio was 80:20 after rimantadine treatment.

/LABORATORY ANIMALS: Developmental or Reproductive Toxicity/ Rimantadine hydrochloride has been reported to be embryotoxic (ie, increased fetal resorption) in rats when administered in a dosage of 200 mg/kg daily; this dose also was associated with several maternal effects including ataxia, tremor, seizures, and substantially reduced weight gain. While developmental abnormality (i.e., change in the ratio of 12 or 13 ribs) was observed in rabbits given rimantadine hydrochloride dosages of 50 mg/kg daily, embryotoxicity was not observed.

For more Non-Human Toxicity Excerpts (Complete) data for RIMANTADINE (6 total), please visit the HSDB record page.

Populations at Special Risk · 1 item

While the effect of rimantadine therapy on the incidence of seizures in patients with seizure disorders has not been fully evaluated, patients with active seizure disorders appear to be at risk of increased frequency of seizures during amantadine therapy. Therefore, rimantadine-treated patients with a history of epilepsy or other seizures should be observed closely for possible seizure activity.

Regulatory information

FDA Requirements · 1 item

The Approved Drug Products with Therapeutic Equivalence Evaluations List identifies currently marketed prescription drug products, incl rimantadine, approved on the basis of safety and effectiveness by FDA under sections 505 of the Federal Food, Drug, and Cosmetic Act.

Safety data

hs_code
2902190000
Signal word
Warning
Symbol(GHS)
GHS07
hazard_class
IRRITANT
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P280-P301+P312-P302+P352-P305+P351+P338

Chemistry & industry

Pharmacology

ATC Code · 2 items

J - Antiinfectives for systemic use

QJ - Antiinfectives for systemic use

Protein BindingApproximately 40% over typical plasma concentrations.
Pharmacodynamics · 1 item

Rimantadine, a cyclic amine, is a synthetic antiviral drug and a derivate of adamantane, like a similar drug amantadine. Rimantadine is inhibitory to the in vitro replication of influenza A virus isolates from each of the three antigenic subtypes (H1N1, H2H2 and H3N2) that have been isolated from man. Rimantadine has little or no activity against influenza B virus. Rimantadine does not appear to interfere with the immunogenicity of inactivated influenza A vaccine.

Mechanism of Action · 3 items

The mechanism of action of rimantadine is not fully understood. Rimantadine appears to exert its inhibitory effect early in the viral replicative cycle, possibly inhibiting the uncoating of the virus. The protein coded by the M2 gene of influenza A may play an important role in rimantadine susceptibility.

Rimantadine is thought to exert its inhibitory effect early in the viral replicative cycle, possibly by blocking or greatly reducing the uncoating of viral RNA within host cells. Genetic studies suggest that a single amino acid change on the transmembrane portion of the M2 protein can completely eliminate influenza A virus susceptibility to rimantadine.

Rimantadine, like amantadine, inhibits viral replication by interfering with the influenza A virus M2 protein, an integral membrane protein. The M2 protein of influenza A functions as an ion channel and is important in at least 2 aspects of virus replication, disassembly of the infecting virus particle and regulation of the ionic environment of the transport pathway. By interfering with the ion channel function of the M2 protein, rimantadine inhibits 2 stages in the replicative cycle of influenza A. Early in the virus reproductive cycle, rimantadine inhibits uncoating of the virus particle, presumably by inhibiting the acid-mediated dissociation of the virion nucleic acid and proteins, which prevents nuclear transport of viral genome material. Rimantadine also prevents viral maturation in some strains of influenza A (e.g., H7 strains) by promoting pH-induced conformational changes in influenza A hemagglutinin during its intracellular transport late in the replicative cycle. Adsorption of the virus to and penetration into cells do not appear to be affected by rimantadine. In addition, rimantadine does not interfere with the synthesis of viral components (e.g., RNA-directed RNA polymerase activity).

Biological Half-Life · 2 items

25 to 30 hours in young adults (22 to 44 years old). Approximately 32 hours in elderly (71 to 79 years old) and in patients with chronic liver disease. Approximately 13 to 38 hours in children (4 to 8 years old).

Young adults (22 to 44 years old): 25 to 30 hours. Older adults (71 to 79 years old) and patients with chronic liver disease: Approximately 32 hours. Children (4 to 8 years old): 13 to 38 hours.

Metabolism/Metabolites · 3 items

Following oral administration, rimantadine is extensively metabolized in the liver with less than 25% of the dose excreted in the urine as unchanged drug. Glucuronidation and hydroxylation are the major metabolic pathways.

Rimantadine hydrochloride is metabolized extensively in the liver to at least 3 hydroxylated metabolites. These have been designated as conjugated and unconjugated 3-, 4a-, and 4beta-hydroxylated metabolites. A glucuronide conjugate of rimantadine also has been identified.

Extensively metabolized in the liver; glucuronidation and hydroxylation are the major metabolic pathways.

Uses & manufacturing

Uses · 2 items

Antiviral

Antiviral; Nucleic Acid Synthesis Inhibitors

Methods of ManufacturingNetherlands 6408505; W.W. Prichard, US 3352912 (1965, 1967 both to duPont).
Formulations/Preparations · 3 items

Oral: Solution: 50 mg/5 mL Flumadine Syrup ( with parabens) (Forest) Tablets, film-coated: 100 mg Flumadine ( with polyethylene glycol) (Forest).

Formulated as the hydrochloride salt

Administered PO, intranasal, SC, IP, or aerosol routes

Applications · 3 items

DescriptionRimantadine (Brand name: Flumadine) is a kind of RNA synthesis inhibitor that used as an orally administrated antiviral drug in the prophylaxis and for the treatment of influenza. It is capable of shortening the duration and alleviated the symptoms of influenza. However, it is now not recommended for the treatment of influenza any longer due to the emergence of resistance problem since 2009. Its mechanism of action is not fully understood. It is indicated that it take effects through inhibiting the viral replication through possibly inhibiting the uncoating process of the virus. The virus M2 protein (an ion channel) seems to play an important role in the susceptibility of influenza A virus to the treatment of Rimantadine.

UsesRimantadine act by blocking the M2 ion channel which is required for uptake of protons into the interior of the virus to permit acid-promoted viral uncoating (decapsidation).

General DescriptionResistant variants of influenza type A have been recoveredfrom rimantadine-treated patients.Resistance with inhibitory concentrations increased morethan 100-fold have been associated with single nucleotidechanges that lead to amino acid substitutions in the transmembranedomain of M2. rimantadineshare cross-susceptibility and resistance.

Upstream & downstream products

Suppliers100 total

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
河北展药生物科技有限公司15369953316 +8615369953316 · [email protected]

Additional notes

DefinitionChEBI: 1-(1-adamantyl)ethanamine is an alkylamine.

Related reactions

2 records

Compound notes

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