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

• ChemBase ID: 268420
• Molecular Formular: C15H12N2
• Molecular Mass: 220.26918
• Monoisotopic Mass: 220.10004839
• SMILES: n1c(c2cc3c(cc2)cccc3)cccc1N
• Canonical SMILES: Nc1cccc(n1)c1ccc2c(c1)cccc2
• InChI: InChI=1S/C15H12N2/c16-15-7-3-6-14(17-15)13-9-8-11-4-1-2-5-12(11)10-13/h1-10H,(H2,16,17)
• InChIKey: YUPHOUYKMQNITF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-(naphthalen-2-yl)pyridin-2-amine
• IUPAC Traditional name: 6-(naphthalen-2-yl)pyridin-2-amine
• Synonyms: 6-(naphthalen-2-yl)pyridin-2-amine

Database IDs

• MDL Number: MFCD12859589
• PubChem SID: 164324330
• PubChem CID: 47003312

CALCULATED PROPERTIES

• Molar Refractivity: 70.1294 cm^3
• Polarizability: 29.278637 Å^3
• Polar Surface Area: 38.91 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 2.8014421
• LogD (pH = 7.4): 3.5183756
• Log P: 3.5436573

PROPERTIES

Physical Property

• Melting Point: 124 - 126°C
• Hydrophobicity(logP): 3.59

Product Information

• Purity: 95%