2-cyclopropylpyrrolidine

• ChemBase ID: 276919
• Molecular Formular: C7H13N
• Molecular Mass: 111.18482
• Monoisotopic Mass: 111.10479942
• SMILES: C1CC1C1CCCN1
• Canonical SMILES: C1CNC(C1)C1CC1
• InChI: InChI=1S/C7H13N/c1-2-7(8-5-1)6-3-4-6/h6-8H,1-5H2
• InChIKey: WOUSTBXLCUPLRA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-cyclopropylpyrrolidine
• IUPAC Traditional name: 2-cyclopropylpyrrolidine
• Synonyms: 2-cyclopropylpyrrolidine

Database IDs

• MDL Number: MFCD02663406
• PubChem SID: 164332829
• PubChem CID: 18070899

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -2.1881053
• LogD (pH = 7.4): -2.1397333
• Log P: 1.0532633
• Molar Refractivity: 33.8466 cm^3
• Polarizability: 13.705201 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.249

Product Information

• Purity: 95%