(1-cyclobutylethyl)(methyl)amine

• ChemBase ID: 246275
• Molecular Formular: C7H15N
• Molecular Mass: 113.2007
• Monoisotopic Mass: 113.12044949
• SMILES: C(C1CCC1)(NC)C
• Canonical SMILES: CNC(C1CCC1)C
• InChI: InChI=1S/C7H15N/c1-6(8-2)7-4-3-5-7/h6-8H,3-5H2,1-2H3
• InChIKey: GBWSPAMRIAOHFY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (1-cyclobutylethyl)(methyl)amine
• IUPAC Traditional name: (1-cyclobutylethyl)(methyl)amine
• Synonyms: (1-cyclobutylethyl)(methyl)amine

Database IDs

• MDL Number: MFCD21117757
• PubChem SID: 164302185
• PubChem CID: 19602314

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.7884468
• LogD (pH = 7.4): -1.5213772
• Log P: 1.4488425
• Molar Refractivity: 35.6552 cm^3
• Polarizability: 14.445701 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.323

Product Information

• Purity: 95%