6-(2-methoxyethoxy)pyridin-3-amine

• ChemBase ID: 256397
• Molecular Formular: C8H12N2O2
• Molecular Mass: 168.19308
• Monoisotopic Mass: 168.08987763
• SMILES: n1c(ccc(c1)N)OCCOC
• Canonical SMILES: COCCOc1ccc(cn1)N
• InChI: InChI=1S/C8H12N2O2/c1-11-4-5-12-8-3-2-7(9)6-10-8/h2-3,6H,4-5,9H2,1H3
• InChIKey: GLRSRWRXPZCBST-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-(2-methoxyethoxy)pyridin-3-amine
• IUPAC Traditional name: 6-(2-methoxyethoxy)pyridin-3-amine
• Synonyms: 6-(2-methoxyethoxy)pyridin-3-amine

Database IDs

• MDL Number: MFCD01692516
• PubChem SID: 164312307
• PubChem CID: 3031385

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): 0.31362158
• LogD (pH = 7.4): 0.31642234
• Log P: 0.3164582
• Molar Refractivity: 46.4217 cm^3
• Polarizability: 17.481337 Å^3
• Polar Surface Area: 57.37 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.853

Product Information

• Purity: 95%