N-cyclopentylcyclohexanamine

• ChemBase ID: 311336
• Molecular Formular: C11H21N
• Molecular Mass: 167.29114
• Monoisotopic Mass: 167.16739968
• SMILES: N(C1CCCC1)C1CCCCC1
• Canonical SMILES: C1CCC(CC1)NC1CCCC1
• InChI: InChI=1S/C11H21N/c1-2-6-10(7-3-1)12-11-8-4-5-9-11/h10-12H,1-9H2
• InChIKey: HTPYKHDZMIJYOU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-cyclopentylcyclohexanamine
• IUPAC Traditional name: N-cyclopentylcyclohexanamine
• Synonyms: N-cyclopentylcyclohexanamine

Database IDs

• CAS Number: 40649-25-0
• MDL Number: MFCD00046340

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -0.27878207
• LogD (pH = 7.4): -0.13688369
• Log P: 2.961094
• Molar Refractivity: 52.1208 cm^3
• Polarizability: 21.091114 Å^3
• Polar Surface Area: 12.03 Å^2