HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium

HCID 3925
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
21306-56-9
Standard SMILES
CC[N+](CC)(CC)CC(=O)Nc1c(C)cccc1C
InChIKey
PYEBKOFMWAMBFV-UHFFFAOYSA-O
Molecular formula
C16H27N2O+
Average molar mass
263.4 g/mol
Monoisotopic mass
263.21233849

Overview

QX-314 is a monocarboxylic acid amide. It has a role as a local anaesthetic.

Names & identifiers

Preferred name
2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium
IUPAC
[2-(2,6-dimethylanilino)-2-oxoethyl]-triethylazanium
English name
QX-314
Molecular formula
C16H27N2O+
Molecular weight
263.4

Names & synonyms

QX-314QX 31446ZIF6Y2X9CHEBI:469372-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium2-[(2,6-dimethylphenyl)amino]-N,N,N-triethyl-2-oxoethanaminiumDTXSID10943813(2-((2,6-dimethylphenyl)amino)-2-oxoethyl)-triethylazanium[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]-triethylazaniumRefChem:178402DTXCID50137217621306-56-9
Show more names
LIDOCAINE N-ETHYL BROMIDEQX-314.BrQX 314 BROMIDEQX 314, 10 mM in DMSOLidocaine N-ethyl bromidLidocaine N-ethyl bromideQX-314 - CAS 21306-56-9 - CalbiochemQX 314 BROMIDE,LIDOCAINE N-ETHYL BROMIDQX-314 bromide (N-Ethyllidocaine bromide)
N-ETHYLLIDOCAINE BROMIDECHEMBL128028Tocris-1014Lopac-L-5783UPCMLD-DP014UNII-46ZIF6Y2X9Lopac0_000679SCHEMBL93854

Database identifiers

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
6
Heavy atoms
19
Formal charge
1
Complexity
268

Physicochemical properties

Melting point
220 · 220 - 222°C
storage temp.
Desiccate at RT
solubility
DMSO (Slightly), Methanol (Slightly)
form
lyophilized solid
color
White to Off-White
Water Solubility
3 mg/mL · water: 3mg/mL
Specific Activity
40 · 40-60 Ci/mmol
Solvent
Ethanol:water (1:1)
Concentration
1 mCi/ml · 1 mCi/ml
Major Application
forensics and toxicologypharmaceutical (small molecule)veterinary
InChI
1S/C16H26N2O.BrH/c1-6-18(7-2,8-3)12-15(19)17-16-13(4)10-9-11-14(16)5;/h9-11H,6-8,12H2,1-5H3;1H
InChIKey
DLHMKHREUTXMCH-UHFFFAOYSA-N
SMILES
[Br-].CC[N+](CC)(CC)CC(=O)Nc1c(C)cccc1C
FDA UNII
46 ZIF6Y2X9 · 46ZIF6Y2X9
UNSPSC Code
41116107 · 41116107

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
Storage Class
11 - Combustible Solids
Hazard statements
H315-H319-H335
Precautionary statements
P261-P280a-P304+P340-P305+P351+P338-P405-P501a

Chemistry & industry

Pharmacology

MeSH Pharmacological Classification · 1 item

Drugs that block nerve conduction when applied locally to nerve tissue in appropriate concentrations. They act on any part of the nervous system and on every type of nerve fiber. In contact with a nerve trunk, these anesthetics can cause both sensory and motor paralysis in the innervated area. Their action is completely reversible. (From Gilman AG, et. al., Goodman and Gilman's The Pharmacological Basis of Therapeutics, 8th ed) Nearly all local anesthetics act by reducing the tendency of voltage-dependent sodium channels to activate.

Applications

UsesBlocker of voltage-activated sodium channels

UsesQX-314 bromide is a derivative of Lidocaine. It is a local anesthetic.

Suppliers30 total

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
上海优宁维生物科技股份有限公司15921930842 15921930842 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
欧利希(湖北)医药科技有限公司17316404525 17316404525 · [email protected]
怀化市冰峰化工有限公司0745-2866851 17711757908 · [email protected]

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
CAS
21306-56-9
PubChem CID
3925
DTXSID
DTXSID10943813
ChEMBL
CHEMBL1180496、CHEMBL128028
ChEBI
CHEBI:46937
UNII
46ZIF6Y2X9
EC Number
633-654-6
Nikkaji
J22.969E
NACRES
77 · NA.77
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
PPE
95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
WGK Germany
3 · 3
Storage Class
11 · 11 - Combustible Solids
Ascent Scientific
4401179829988 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
杭州宇昊化工科技有限公司0571-82693216 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
南通全益生物科技有限公司0513-66337626 18051384581 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
上海立崎生物医学研究中心18014399201 · [email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
Capot Chemical Co.,Ltd.+86-(0)57185586718 +86-13336195806 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
上海鼓臣生物技术有限公司021-34675735 19147740836 · [email protected]