[(2,2-dimethylcyclopropyl)methyl](methyl)amine

• ChemBase ID: 308600
• Molecular Formular: C7H15N
• Molecular Mass: 113.2007
• Monoisotopic Mass: 113.12044949
• SMILES: C1(CC1CNC)(C)C
• Canonical SMILES: CNCC1CC1(C)C
• InChI: InChI=1S/C7H15N/c1-7(2)4-6(7)5-8-3/h6,8H,4-5H2,1-3H3
• InChIKey: DEYFGXAJBCGHEC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(2,2-dimethylcyclopropyl)methyl](methyl)amine
• IUPAC Traditional name: [(2,2-dimethylcyclopropyl)methyl](methyl)amine
• Synonyms: 1-(2,2-dimethylcyclopropyl)-N-methylmethanamine

Database IDs

• CAS Number: 1199779-11-7
• MDL Number: MFCD12827468

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -2.0606813
• LogD (pH = 7.4): -1.7226837
• Log P: 1.174765
• Molar Refractivity: 35.6591 cm^3
• Polarizability: 14.445701 Å^3
• Polar Surface Area: 12.03 Å^2