chempirical

Carbetamide

C12H16N2O3CAS 16118-49-3236.27 g/mol

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Properties

Molecular formula
C12H16N2O3
Molar mass
236.27 g/mol
Exact mass
236.1161 Da
Melting point
119 °C
logP
2.61Crippen estimate
Polar surface area
74.4 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
4
Stereocentres
Rin SMILES atom order

Identifiers

CAS number
16118-49-3
SMILES
CCN=C(O)[C@@H](C)OC(O)=Nc1ccccc1
InChIKey
AMRQXHFXNZFDCH-SECBINFHSA-N
InChI
InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)/t9-/m1/s1

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Names and synonyms

9 names
  • Propanamide, N-ethyl-2-[[(phenylamino)carbonyl]oxy]-, (2R)-
  • Lactamide, N-ethyl-, carbanilate (ester), D-
  • Propanamide, N-ethyl-2-[[(phenylamino)carbonyl]oxy]-, (R)-
  • (2R)-N-Ethyl-2-[[(phenylamino)carbonyl]oxy]propanamide
  • RP 11561
  • 11561RP
  • Carbethamide
  • Carbetamex
  • Legurame PM

Work with Carbetamide

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

Propham122-42-955 % similar Ethyl N-phenylcarbamate101-99-549 % similar Chlorpropham101-21-340 % similar Desmedipham13684-56-539 % similar N-[(Phenylmethoxy)carbonyl]-L-alanyl-L-alanine16012-70-738 % similar (-)-4-Phenyl-2-oxazolidinone90319-52-137 % similar (S)-(+)-4-Phenyl-2-oxazolidinone99395-88-737 % similar Benzyloxycarbonyl-L-alanine1142-20-736 % similar

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

Same formula

Alanylphenylalanine1999-45-7 L-Alanyl-L-phenylalanine3061-90-3 L-Phenylalanyl-L-alanine3918-87-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook