N-benzyl-N-methylpiperidine-4-carboxamide

• ChemBase ID: 311630
• Molecular Formular: C14H20N2O
• Molecular Mass: 232.3214
• Monoisotopic Mass: 232.15756327
• SMILES: C(=O)(N(Cc1ccccc1)C)C1CCNCC1
• Canonical SMILES: CN(C(=O)C1CCNCC1)Cc1ccccc1
• InChI: InChI=1S/C14H20N2O/c1-16(11-12-5-3-2-4-6-12)14(17)13-7-9-15-10-8-13/h2-6,13,15H,7-11H2,1H3
• InChIKey: KCGJGWKYMLRMOM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-benzyl-N-methylpiperidine-4-carboxamide
• IUPAC Traditional name: N-benzyl-N-methylpiperidine-4-carboxamide
• Synonyms: N-benzyl-N-methylpiperidine-4-carboxamide

Database IDs

• CAS Number: 686255-79-8
• MDL Number: MFCD03372499

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -1.9808563
• LogD (pH = 7.4): -1.3964207
• Log P: 1.2451148
• Molar Refractivity: 69.3035 cm^3
• Polarizability: 27.072113 Å^3
• Polar Surface Area: 32.34 Å^2