2-[(2R)-pyrrolidin-2-yl]pyridine

• ChemBase ID: 806819
• Molecular Formular: C9H12N2
• Molecular Mass: 148.20498
• Monoisotopic Mass: 148.10004839
• SMILES: n1c(cccc1)[C@@H]1NCCC1
• Canonical SMILES: C1CN[C@H](C1)c1ccccn1
• InChI: InChI=1S/C9H12N2/c1-2-6-10-8(4-1)9-5-3-7-11-9/h1-2,4,6,9,11H,3,5,7H2/t9-/m1/s1
• InChIKey: NDCZQFDBSPOUDF-SECBINFHSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-[(2R)-pyrrolidin-2-yl]pyridine
• IUPAC Traditional name: 2-[(2R)-pyrrolidin-2-yl]pyridine
• Synonyms: (R)-2-PYRROLIDIN-2-YL-PYRIDINE

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.149065
• LogD (pH = 7.4): -1.0010976
• Log P: 1.0131478
• Molar Refractivity: 43.9132 cm^3
• Polarizability: 17.60422 Å^3
• Polar Surface Area: 24.92 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%