(2-Benzyl-1-methylcyclopentyl)methanimidic acid

HCID 54591

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Basic information

CAS: 80649-70-3
Standard SMILES: CC1(NC=O)CCCC1Cc1ccccc1
InChIKey: NPBFOOPSVSEQLG-UHFFFAOYSA-N
Molecular formula: C14H19NO
Average molar mass: 217.31 g/mol
Monoisotopic mass: 217.14666423

Names & identifiers

Preferred name: (2-Benzyl-1-methylcyclopentyl)methanimidic acid
IUPAC: N-(2-benzyl-1-methylcyclopentyl)formamide

Names & synonyms

80649-70-3DTXSID501001381(2-Benzyl-1-methylcyclopentyl)methanimidic acidRefChem:1049657DTXCID401428332N-(2-Benzyl-1-methylcyclopentyl)formamideBRN 4982810N-(1-Methyl-2-(phenylmethyl)cyclopentyl)formamideFORMAMIDE, N-(1-METHYL-2-(PHENYLMETHYL)CYCLOPENTYL)-

Database identifiers

CAS: 80649-70-3
PubChem CID: 54591
DTXSID: DTXSID501001381

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 3
Heavy atoms: 16
Formal charge: 0
Complexity: 235

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