chempirical

trans-Cinnamamide

C9H9NOCAS 22031-64-7147.18 g/mol

Open in Covalent MOL file
H2NO
Alkene

Properties

Molecular formula
C9H9NO
Molar mass
147.18 g/mol
Exact mass
147.0684 Da
Melting point
148 °C
logP
2.24Crippen estimate
Polar surface area
44.1 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
2
Double bonds
EE/Z, in SMILES order

Identifiers

CAS number
22031-64-7
SMILES
N=C(O)/C=C/c1ccccc1
InChIKey
APEJMQOBVMLION-VOTSOKGWSA-N
InChI
InChI=1S/C9H9NO/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H2,10,11)/b7-6+

Weigh it out

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

Names and synonyms

11 names
  • 2-Propenamide, 3-phenyl-, (2E)-
  • Cinnamamide, (E)-
  • 2-Propenamide, 3-phenyl-, (E)-
  • (2E)-3-Phenyl-2-propenamide
  • trans-Cinnamic acid amide
  • trans-Cinnamoylamine
  • trans-β-(Aminocarbonyl)styrene
  • U 2422
  • (E)-Cinnamamide
  • trans-3-Phenyl-2-propenamide
  • (E)-3-Phenyl-2-propenamide

Work with trans-Cinnamamide

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

Cinnamamide621-79-4100 % similar Cinnamic acid140-10-353 % similar Cinnamic acid621-82-953 % similar (1E,4E)-1,5-Diphenyl-1,4-pentadien-3-one35225-79-748 % similar (E)-Stilbene103-30-046 % similar Fumaramide627-64-546 % similar trans-Chalcone614-47-145 % similar Chalcone94-41-745 % similar

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

Same formula

5-Methoxyindole1006-94-6 (4-Methoxyphenyl)acetonitrile104-47-2 Indole-4-methanol1074-85-7 1H-Indole-7-methanol1074-87-9 Indole-5-methanol1075-25-8 6-Hydroxymethylindole1075-26-9 3,4-Dihydroisoquinolin-1(2H)-one1196-38-9 2-Methyl-1H-indol-5-ol13314-85-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook