Basic information
- CAS
561-76-2- Standard SMILES
CC(C)OC(=O)C1(c2ccccc2)CCN(C)CC1- InChIKey
XJKQCILVUHXVIQ-UHFFFAOYSA-N- Molecular formula
- C16H23NO2
- Average molar mass
- 261.36 g/mol
- Monoisotopic mass
- 261.17287898
Overview
Properidine is a DEA Schedule I controlled substance. Substances in the DEA Schedule I have no currently accepted medical use in the United States, a lack of accepted safety for use under medical supervision, and a high potential for abuse. It is a Opiates substance.
Names & identifiers
- Preferred name
- Properidine
- IUPAC
- propan-2-yl 1-methyl-4-phenylpiperidine-4-carboxylate
- English name
- properidine
- Molecular formula
- C16H23NO2
- Molecular weight
- 261.36
Names & synonyms
PROPERIDINEIpropethidineGevelinaIsopedineProperidinProperidinaProperidinum561-76-2Properidine [INN:BAN:DCF]Properidinum [INN-Latin]Isopropyl 1-methyl-4-phenylpiperidine-4-carboxylateProperidina [INN-Spanish]
Show more names
XJKQCILVUHXVIQ-UHFFFAOYSA-NPethidine Hydrochloride Impurity GOxytocin Impurity 2 TrifluoroacetatePethidine Hydrochloride EP Impurity G1-methyl-4-phenyl-isonipecot isopropyl esterpropan-2-yl 1-methyl-4-phenylpiperidine-4-carboxylatepropan-2-yl 1-methyl-4-phenyl-piperidine-4-carboxylate1-Methylethyl 1-methyl-4-phenylpiperidine-4-carboxylate,
UNII-R1493W1CJ0IDS-NP-015Isopropyl 1-methyl-4-phenylisonipecotateR1493W1CJ0EINECS 209-222-4PROPERIDINE [INN]4-Piperidinecarboxylic acid, 1-methyl-4-phenyl-, 1-methylethyl ester1-Methyl-4-phenylpiperidine-4-carboxylic acid isopropyl ester
Database identifiers
- CAS
561-76-2- PubChem CID
- 62373
- DTXSID
DTXSID20204644- ChEMBL
CHEMBL2105312- UNII
- R1493W1CJ0
- EC Number
- 209-222-4
- Nikkaji
- J6.496C
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 300
Experimental & physicochemical properties
Drugs
DEA NFLIS-Drug Category -> Narcotic Analgesics
DEA Schedule I Controlled Substance -> Opiates
Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds
Physicochemical properties
- Boiling point
- 339.6 · 339.6±42.0 °C(Predicted)
- Density
- 1.04 · 1.040±0.06 g/cm3(Predicted)
- pka
- 7.87 · 7.87±0.10(Predicted)
- FDA UNII
- 1493 W1CJ0 · R1493W1CJ0
- DEA Controlled Substances
- 9644 CSA · CSCN: 9644CSA SCH: Schedule INARC: Yes
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationDEA schedule I controlled substance
Safety data
- DEA Controlled Substances
- CSCN: 9644CSA SCH: Schedule INARC: Yes
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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