1-(2-methoxyethyl)cyclopentan-1-amine

• ChemBase ID: 245263
• Molecular Formular: C8H17NO
• Molecular Mass: 143.22668
• Monoisotopic Mass: 143.13101417
• SMILES: C1(N)(CCOC)CCCC1
• Canonical SMILES: COCCC1(N)CCCC1
• InChI: InChI=1S/C8H17NO/c1-10-7-6-8(9)4-2-3-5-8/h2-7,9H2,1H3
• InChIKey: MQHQFWDITNJYKO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-(2-methoxyethyl)cyclopentan-1-amine
• IUPAC Traditional name: 1-(2-methoxyethyl)cyclopentan-1-amine
• Synonyms: 1-(2-methoxyethyl)cyclopentan-1-amine

Database IDs

• MDL Number: MFCD16818538
• PubChem SID: 164301173
• PubChem CID: 62620487

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.3639567
• LogD (pH = 7.4): -2.1682928
• Log P: 0.66599596
• Molar Refractivity: 42.1305 cm^3
• Polarizability: 16.955612 Å^3
• Polar Surface Area: 35.25 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.257

Product Information

• Purity: 95%