2-ethylcyclopropan-1-amine

• ChemBase ID: 275095
• Molecular Formular: C5H11N
• Molecular Mass: 85.14754
• Monoisotopic Mass: 85.08914936
• SMILES: C1(CC1CC)N
• Canonical SMILES: CCC1CC1N
• InChI: InChI=1S/C5H11N/c1-2-4-3-5(4)6/h4-5H,2-3,6H2,1H3
• InChIKey: GAZWKJNMLLGPKV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-ethylcyclopropan-1-amine
• IUPAC Traditional name: 2-ethylcyclopropan-1-amine
• Synonyms: 2-ethylcyclopropan-1-amine

Database IDs

• MDL Number: MFCD11100380
• PubChem SID: 164331005
• PubChem CID: 12953697

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -2.370578
• LogD (pH = 7.4): -1.853521
• Log P: 0.6496472
• Molar Refractivity: 26.2026 cm^3
• Polarizability: 10.75224 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.968

Product Information

• Purity: 95%