1,5-naphthyridin-2-amine

• ChemBase ID: 286918
• Molecular Formular: C8H7N3
• Molecular Mass: 145.16128
• Monoisotopic Mass: 145.06399724
• SMILES: Nc1nc2cccnc2cc1
• Canonical SMILES: Nc1ccc2c(n1)cccn2
• InChI: InChI=1S/C8H7N3/c9-8-4-3-6-7(11-8)2-1-5-10-6/h1-5H,(H2,9,11)
• InChIKey: WVXADFXJVONWJY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,5-naphthyridin-2-amine
• IUPAC Traditional name: 1,5-naphthyridin-2-amine
• Synonyms: 1,5-Naphthyridin-2-amine

Database IDs

• CAS Number: 17965-80-9
• PubChem SID: 180672449
• PubChem CID: 589355

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): 1.0618365
• LogD (pH = 7.4): 1.064575
• Log P: 1.06461
• Molar Refractivity: 42.4643 cm^3
• Polarizability: 17.211117 Å^3
• Polar Surface Area: 51.8 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%