3-(prop-2-en-1-yloxy)pyridin-2-amine

• ChemBase ID: 308426
• Molecular Formular: C8H10N2O
• Molecular Mass: 150.1778
• Monoisotopic Mass: 150.07931295
• SMILES: c1(ncccc1OCC=C)N
• Canonical SMILES: Nc1ncccc1OCC=C
• InChI: InChI=1S/C8H10N2O/c1-2-6-11-7-4-3-5-10-8(7)9/h2-5H,1,6H2,(H2,9,10)
• InChIKey: NJEQGEPUZHZYPB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 3-(prop-2-en-1-yloxy)pyridin-2-amine
• IUPAC Traditional name: 3-(prop-2-en-1-yloxy)pyridin-2-amine
• Synonyms: 3-(allyloxy)-2-pyridinamine

Database IDs

• CAS Number: 24015-99-4
• MDL Number: MFCD09971312

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): 0.1523516
• LogD (pH = 7.4): 1.0411365
• Log P: 1.0946835
• Molar Refractivity: 44.5409 cm^3
• Polarizability: 16.528782 Å^3
• Polar Surface Area: 48.14 Å^2