Benzyl nitrile lidocaine analog

HCID 198524

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Basic information

CAS: 70121-39-0
Standard SMILES: CCN(CC)CC(=O)Nc1[nH]c(Cc2ccccc2)c(C)c1C#N.Cl
InChIKey: DOUUOCRORDVWMQ-UHFFFAOYSA-N
Molecular formula: C19H25ClN4O
Average molar mass: 360.9 g/mol
Monoisotopic mass: 360.1716891

Overview

structure given in first source

Names & identifiers

Preferred name: Benzyl nitrile lidocaine analog
IUPAC: N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-2-(diethylamino)acetamide;hydrochloride

Names & synonyms

70121-39-0DTXSID20220405Acetamide, N-(3-cyano-4-methyl-5-(phenylmethyl)-1H-pyrrol-2-yl)-2-(diethylamino)-, monohydrochlorideRefChem:118889DTXCID801428962-(Diethylaminoacetamido)-3-cyano-4-methyl-5-benzylpyrrole hydrochlorideAcetamide, N-(3-cyano-4-methyl-5-(phenylmethyl)-1H-pyrrol-2-yl)-2-(diethylamino)-, HClAcetamide, N-(3-cyano-4-methyl-5-benzyl-1H-pyrrol-2-yl)-2-diethylamino-, hydrochlorideN-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-2-(diethylamino)acetamide;hydrochlorideN-(5-Benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-N~2~,N~2~-diethylglycinamide--hydrogen chloride (1/1)

Database identifiers

CAS: 70121-39-0
PubChem CID: 198524
DTXSID: DTXSID20220405

Properties

Computed structural properties

Topological polar surface area: 71.9 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 3
Rotatable bonds: 7
Heavy atoms: 25
Formal charge: 0
Complexity: 448

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