2-(2-methoxyethoxy)pyridin-3-amine

• ChemBase ID: 269660
• Molecular Formular: C8H12N2O2
• Molecular Mass: 168.19308
• Monoisotopic Mass: 168.08987763
• SMILES: c1(ncccc1N)OCCOC
• Canonical SMILES: COCCOc1ncccc1N
• InChI: InChI=1S/C8H12N2O2/c1-11-5-6-12-8-7(9)3-2-4-10-8/h2-4H,5-6,9H2,1H3
• InChIKey: JRBZDPWWGGLQNE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(2-methoxyethoxy)pyridin-3-amine
• IUPAC Traditional name: 2-(2-methoxyethoxy)pyridin-3-amine
• Synonyms: 2-(2-methoxyethoxy)pyridin-3-amine

Database IDs

• MDL Number: MFCD09815653
• PubChem SID: 164325570
• PubChem CID: 18070218

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): 0.3137287
• LogD (pH = 7.4): 0.3164237
• Log P: 0.3164582
• Molar Refractivity: 46.4217 cm^3
• Polarizability: 17.483168 Å^3
• Polar Surface Area: 57.37 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.052

Product Information

• Purity: 95%