4-(2-ethoxypyridin-3-yl)morpholine

• ChemBase ID: 797091
• Molecular Formular: C11H16N2O2
• Molecular Mass: 208.25694
• Monoisotopic Mass: 208.12117776
• SMILES: C1COCCN1c1c(nccc1)OCC
• Canonical SMILES: CCOc1ncccc1N1CCOCC1
• InChI: InChI=1S/C11H16N2O2/c1-2-15-11-10(4-3-5-12-11)13-6-8-14-9-7-13/h3-5H,2,6-9H2,1H3
• InChIKey: IWEVHEHCDRZAOJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-(2-ethoxypyridin-3-yl)morpholine
• IUPAC Traditional name: 4-(2-ethoxypyridin-3-yl)morpholine
• Synonyms: 4-(2-Ethoxypyridin-3-yl)Morpholine

Database IDs

• CAS Number: 200064-08-0

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): 1.4354101
• LogD (pH = 7.4): 1.4386693
• Log P: 1.438711
• Molar Refractivity: 58.9295 cm^3
• Polarizability: 22.269056 Å^3
• Polar Surface Area: 34.59 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 97%