chempirical

Paprazine

C17H17NO3CAS 36417-86-4283.33 g/mol

Open in Covalent MOL file
OOHNHHO
AlkenePhenol

Properties

Molecular formula
C17H17NO3
Molar mass
283.33 g/mol
Exact mass
283.1208 Da
Melting point
234–236 °C
logP
3.31Crippen estimate
Polar surface area
73.0 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
5
Double bonds
EE/Z, in SMILES order

Identifiers

CAS number
36417-86-4
SMILES
OC(/C=C/c1ccc(O)cc1)=NCCc1ccc(O)cc1
InChIKey
RXGUTQNKCXHALN-BJMVGYQFSA-N
InChI
InChI=1S/C17H17NO3/c19-15-6-1-13(2-7-15)5-10-17(21)18-12-11-14-3-8-16(20)9-4-14/h1-10,19-20H,11-12H2,(H,18,21)/b10-5+

Weigh it out

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

Names and synonyms

14 names · show all
  • 2-Propenamide, 3-(4-hydroxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-, (2E)-
  • 2-Propenamide, 3-(4-hydroxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-, (E)-
  • (2E)-3-(4-Hydroxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-2-propenamide
  • N-(p-Hydroxy-β-phenylethyl)-p-hydroxy-trans-cinnamamide
  • trans-N-(p-Coumaroyl)tyramine
  • N-(p-trans-Coumaroyl)tyramine
  • (E)-3-(4-Hydroxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide
  • trans-4-Coumaroyltyramine
  • 4-Coumaroyltyramine
  • N-trans-Coumaroyltyramine
  • N-E-Coumaroyltyramine
  • N-trans-p-Coumaroyltyramine
  • E-N-Coumaroyltyramine
  • (E)-3-(4-Hydroxyphenyl)-N-phenylethyl acrylamide

Work with Paprazine

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

N-trans-Feruloyltyramine66648-43-966 % similar P-Coumaric acid501-98-446 % similar P-Coumaric acid7400-08-046 % similar Bisdemethoxycurcumin33171-05-045 % similar 1,5-Bis(4-hydroxyphenyl)-1,4-pentadien-3-one3654-49-745 % similar (4-Hydroxybenzylidene)acetone3160-35-841 % similar 4-Hydroxychalcone20426-12-440 % similar Methyl P-coumarate3943-97-339 % similar

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

Same formula

(9H-Fluoren-9-yl)methyl N-(2-hydroxyethyl)carbamate105496-31-9 Coumarin 33455804-67-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook