5-ethoxypyridin-2-amine

• ChemBase ID: 288958
• Molecular Formular: C7H10N2O
• Molecular Mass: 138.1671
• Monoisotopic Mass: 138.07931295
• SMILES: Nc1ncc(OCC)cc1
• Canonical SMILES: CCOc1ccc(nc1)N
• InChI: InChI=1S/C7H10N2O/c1-2-10-6-3-4-7(8)9-5-6/h3-5H,2H2,1H3,(H2,8,9)
• InChIKey: WCKZZIDVKJIEAP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5-ethoxypyridin-2-amine
• IUPAC Traditional name: 5-ethoxypyridin-2-amine
• Synonyms: 5-Ethoxypyridin-2-amine

Database IDs

• CAS Number: 89943-11-3
• PubChem SID: 180674489
• PubChem CID: 19367103

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): 0.0490585
• LogD (pH = 7.4): 0.6978572
• Log P: 0.72024167
• Molar Refractivity: 40.1268 cm^3
• Polarizability: 14.9290495 Å^3
• Polar Surface Area: 48.14 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%