N-methyl-N-[2-(methylamino)ethyl]cyclopentanamine

• ChemBase ID: 307146
• Molecular Formular: C9H20N2
• Molecular Mass: 156.2685
• Monoisotopic Mass: 156.16264865
• SMILES: N(C1CCCC1)(CCNC)C
• Canonical SMILES: CNCCN(C1CCCC1)C
• InChI: InChI=1S/C9H20N2/c1-10-7-8-11(2)9-5-3-4-6-9/h9-10H,3-8H2,1-2H3
• InChIKey: AHNPSXMOXGQMPF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-methyl-N-[2-(methylamino)ethyl]cyclopentanamine
• IUPAC Traditional name: N-methyl-N-[2-(methylamino)ethyl]cyclopentanamine
• Synonyms: N-cyclopentyl-N,N'-dimethylethane-1,2-diamine

Database IDs

• CAS Number: 938459-03-1
• MDL Number: MFCD09055297

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.661665
• LogD (pH = 7.4): -1.4211713
• Log P: 1.180468
• Molar Refractivity: 49.1257 cm^3
• Polarizability: 19.657892 Å^3
• Polar Surface Area: 15.27 Å^2