[3-(aminomethyl)cyclobutyl]methanol

• ChemBase ID: 310200
• Molecular Formular: C6H13NO
• Molecular Mass: 115.17352
• Monoisotopic Mass: 115.09971404
• SMILES: C1(CC(C1)CO)CN
• Canonical SMILES: NCC1CC(C1)CO
• InChI: InChI=1S/C6H13NO/c7-3-5-1-6(2-5)4-8/h5-6,8H,1-4,7H2
• InChIKey: MWOHKMZOEUQKBH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [3-(aminomethyl)cyclobutyl]methanol
• IUPAC Traditional name: [3-(aminomethyl)cyclobutyl]methanol
• Synonyms: [3-(aminomethyl)cyclobutyl]methanol

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -3.4962943
• LogD (pH = 7.4): -3.0849683
• Log P: -0.47201872
• Molar Refractivity: 32.8621 cm^3
• Polarizability: 13.196873 Å^3
• Polar Surface Area: 46.25 Å^2