(cyclopentylmethyl)(methyl)amine

• ChemBase ID: 309671
• Molecular Formular: C7H15N
• Molecular Mass: 113.2007
• Monoisotopic Mass: 113.12044949
• SMILES: N(CC1CCCC1)C
• Canonical SMILES: CNCC1CCCC1
• InChI: InChI=1S/C7H15N/c1-8-6-7-4-2-3-5-7/h7-8H,2-6H2,1H3
• InChIKey: XLXBMMXDVLSNGN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (cyclopentylmethyl)(methyl)amine
• IUPAC Traditional name: (cyclopentylmethyl)(methyl)amine
• Synonyms: (cyclopentylmethyl)methylamine

Database IDs

• CAS Number: 4492-51-7
• MDL Number: MFCD11212401

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.7600617
• LogD (pH = 7.4): -1.4768975
• Log P: 1.4768361
• Molar Refractivity: 35.8374 cm^3
• Polarizability: 14.445701 Å^3
• Polar Surface Area: 12.03 Å^2