2-methyl-6-(pyrrolidin-2-yl)pyridine

• ChemBase ID: 239556
• Molecular Formular: C10H14N2
• Molecular Mass: 162.23156
• Monoisotopic Mass: 162.11569846
• SMILES: n1c(C2NCCC2)cccc1C
• Canonical SMILES: Cc1cccc(n1)C1CCCN1
• InChI: InChI=1S/C10H14N2/c1-8-4-2-5-10(12-8)9-6-3-7-11-9/h2,4-5,9,11H,3,6-7H2,1H3
• InChIKey: PSIDVXGUGGWTKZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-methyl-6-(pyrrolidin-2-yl)pyridine
• IUPAC Traditional name: 2-methyl-6-(pyrrolidin-2-yl)pyridine
• Synonyms: 2-methyl-6-(pyrrolidin-2-yl)pyridine; 2-METHYL-6-PYRROLIDIN-2-YL-PYRIDINE

Database IDs

• CAS Number: 23894-40-8
• MDL Number: MFCD07374372
• PubChem SID: 164295466
• PubChem CID: 55252866

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.0239897
• LogD (pH = 7.4): -0.9021076
• Log P: 1.144518
• Molar Refractivity: 48.5047 cm^3
• Polarizability: 19.371254 Å^3
• Polar Surface Area: 24.92 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.936

Product Information

• Purity: 95%; 98%