3-[(2R)-piperidin-2-yl]pyridine

• ChemBase ID: 804628
• Molecular Formular: C10H14N2
• Molecular Mass: 162.23156
• Monoisotopic Mass: 162.11569846
• SMILES: n1cc(ccc1)[C@@H]1NCCCC1
• Canonical SMILES: C1CC[C@@H](NC1)c1cccnc1
• InChI: InChI=1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2/t10-/m1/s1
• InChIKey: MTXSIJUGVMTTMU-SNVBAGLBSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 3-[(2R)-piperidin-2-yl]pyridine
• IUPAC Traditional name: 3-[(2R)-piperidin-2-yl]pyridine
• Synonyms: 3-((2R)-2-PIPERIDYL)PYRIDINE

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -1.9107507
• LogD (pH = 7.4): -0.6504358
• Log P: 1.2240554
• Molar Refractivity: 48.9613 cm^3
• Polarizability: 19.449373 Å^3
• Polar Surface Area: 24.92 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%