6-(6-aminopyridin-2-yl)pyridin-2-amine

• ChemBase ID: 52713
• Molecular Formular: C10H10N4
• Molecular Mass: 186.2132
• Monoisotopic Mass: 186.09054634
• SMILES: c1(cccc(n1)N)c1cccc(n1)N
• Canonical SMILES: Nc1cccc(n1)c1cccc(n1)N
• InChI: InChI=1S/C10H10N4/c11-9-5-1-3-7(13-9)8-4-2-6-10(12)14-8/h1-6H,(H2,11,13)(H2,12,14)
• InChIKey: YKSWVQYWQSZDPR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-(6-aminopyridin-2-yl)pyridin-2-amine
• IUPAC Traditional name: 6-(6-aminopyridin-2-yl)pyridin-2-amine
• Synonyms: 2,2'-Bipyridine-6,6'-diamine

Database IDs

• CAS Number: 93127-75-4
• MDL Number: MFCD04117918
• PubChem SID: 162057476
• PubChem CID: 10561426

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): 1.3614279
• LogD (pH = 7.4): 1.4860407
• Log P: 1.4878901
• Molar Refractivity: 56.1642 cm^3
• Polarizability: 21.791073 Å^3
• Polar Surface Area: 77.82 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95%