(2S)-2-cyclopentylpiperazine

• ChemBase ID: 808088
• Molecular Formular: C9H18N2
• Molecular Mass: 154.25262
• Monoisotopic Mass: 154.14699859
• SMILES: [C@@H]1(CNCCN1)C1CCCC1
• Canonical SMILES: C1CN[C@H](CN1)C1CCCC1
• InChI: InChI=1S/C9H18N2/c1-2-4-8(3-1)9-7-10-5-6-11-9/h8-11H,1-7H2/t9-/m1/s1
• InChIKey: NUQCVJHZZHYMBF-SECBINFHSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2S)-2-cyclopentylpiperazine
• IUPAC Traditional name: (2S)-2-cyclopentylpiperazine
• Synonyms: (S)-2-CYCLOPENTYL-PIPERAZINE

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -2.4912696
• LogD (pH = 7.4): -1.3388416
• Log P: 1.0006748
• Molar Refractivity: 46.263 cm^3
• Polarizability: 18.918522 Å^3
• Polar Surface Area: 24.06 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%