(1-cyclopentylpyrrolidin-3-yl)methanamine

• ChemBase ID: 307616
• Molecular Formular: C10H20N2
• Molecular Mass: 168.2792
• Monoisotopic Mass: 168.16264865
• SMILES: N1(CC(CC1)CN)C1CCCC1
• Canonical SMILES: NCC1CCN(C1)C1CCCC1
• InChI: InChI=1S/C10H20N2/c11-7-9-5-6-12(8-9)10-3-1-2-4-10/h9-10H,1-8,11H2
• InChIKey: MGDCKTCOYNYEIP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (1-cyclopentylpyrrolidin-3-yl)methanamine
• IUPAC Traditional name: (1-cyclopentylpyrrolidin-3-yl)methanamine
• Synonyms: 1-(1-cyclopentyl-3-pyrrolidinyl)methanamine

Database IDs

• CAS Number: 933714-21-7
• MDL Number: MFCD09931093

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -5.2204585
• LogD (pH = 7.4): -3.346727
• Log P: 0.8136379
• Molar Refractivity: 51.9013 cm^3
• Polarizability: 20.7646 Å^3
• Polar Surface Area: 29.26 Å^2