N,6-dimethylpyridin-2-amine

• ChemBase ID: 276103
• Molecular Formular: C7H10N2
• Molecular Mass: 122.1677
• Monoisotopic Mass: 122.08439833
• SMILES: n1c(NC)cccc1C
• Canonical SMILES: CNc1cccc(n1)C
• InChI: InChI=1S/C7H10N2/c1-6-4-3-5-7(8-2)9-6/h3-5H,1-2H3,(H,8,9)
• InChIKey: PFVYSURSVXECJA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N,6-dimethylpyridin-2-amine
• IUPAC Traditional name: N,6-dimethylpyridin-2-amine
• Synonyms: N,6-dimethylpyridin-2-amine

Database IDs

• CAS Number: 97986-08-8
• MDL Number: MFCD10697830
• PubChem SID: 164332013
• PubChem CID: 3839092

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.70032495
• LogD (pH = 7.4): 0.6353512
• Log P: 0.9541792
• Molar Refractivity: 38.9999 cm^3
• Polarizability: 14.1782675 Å^3
• Polar Surface Area: 24.92 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.615

Product Information

• Purity: 95%; 98%