N-ethyl-N-methylprop-2-enamide

• ChemBase ID: 240848
• Molecular Formular: C6H11NO
• Molecular Mass: 113.15764
• Monoisotopic Mass: 113.08406398
• SMILES: C(=O)(N(CC)C)C=C
• Canonical SMILES: CN(C(=O)C=C)CC
• InChI: InChI=1S/C6H11NO/c1-4-6(8)7(3)5-2/h4H,1,5H2,2-3H3
• InChIKey: ZOTWHNWBICCBPC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-ethyl-N-methylprop-2-enamide
• IUPAC Traditional name: N-ethyl-N-methylprop-2-enamide
• Synonyms: N-ethyl-N-methylprop-2-enamide

Database IDs

• MDL Number: MFCD12091461
• PubChem SID: 164296758
• PubChem CID: 10441673

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 0.5301231
• LogD (pH = 7.4): 0.53016424
• Log P: 0.5301648
• Molar Refractivity: 33.6556 cm^3
• Polarizability: 12.746525 Å^3
• Polar Surface Area: 20.31 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.362

Product Information

• Purity: 95%