2-cyclobutylpiperazine

• ChemBase ID: 808084
• Molecular Formular: C8H16N2
• Molecular Mass: 140.22604
• Monoisotopic Mass: 140.13134852
• SMILES: C1(CNCCN1)C1CCC1
• Canonical SMILES: C1CNC(CN1)C1CCC1
• InChI: InChI=1S/C8H16N2/c1-2-7(3-1)8-6-9-4-5-10-8/h7-10H,1-6H2
• InChIKey: DSHDROYIJFRITB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-cyclobutylpiperazine
• IUPAC Traditional name: 2-cyclobutylpiperazine
• Synonyms: 2-CYCLOBUTYL-PIPERAZINE

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -2.912446
• LogD (pH = 7.4): -1.7479401
• Log P: 0.55610615
• Molar Refractivity: 41.662 cm^3
• Polarizability: 17.072641 Å^3
• Polar Surface Area: 24.06 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%