4-Methyl-3-oxo-N-phenyl-2-(phenylmethylene)pentanamide

C₁₉H₁₉NO₂CAS 125971-57-5293.37 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₉H₁₉NO₂
Molar mass: 293.37 g/mol
Exact mass: 293.1416 Da
Melting point: 190–193 °C
logP: 4.58Crippen estimate
Polar surface area: 49.7 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 5

Identifiers

CAS number

125971-57-5

SMILES

CC(C)C(=O)C(=Cc1ccccc1)C(O)=Nc1ccccc1

InChIKey

SMUFHBOCNIUNPT-UHFFFAOYSA-N

InChI

InChI=1S/C19H19NO2/c1-14(2)18(21)17(13-15-9-5-3-6-10-15)19(22)20-16-11-7-4-8-12-16/h3-14H,1-2H3,(H,20,22)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

2 names

Pentanamide, 4-methyl-3-oxo-N-phenyl-2-(phenylmethylene)-
2-Isobutyryl-N-phenyl-3-phenylacrylamide

Work with 4-Methyl-3-oxo-N-phenyl-2-(phenylmethylene)pentanamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-(Phenylmethylene)-2,4-pentanedione4335-90-440 % similar Diethyl benzylidenemalonate5292-53-538 % similar α-Methylcinnamic acid1199-77-538 % similar Acetanilide103-84-437 % similar Cinnamyl isobutyrate103-59-336 % similar 2-(Acetylamino)-3-phenyl-2-propenoic acid5469-45-436 % similar Propham122-42-935 % similar 2-Fluoro-3-phenyl-2-propenoic acid350-90-335 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook