Carbetamide

C₁₂H₁₆N₂O₃CAS 16118-49-3236.27 g/mol

Open in Covalent MOL file

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 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 4
Stereocentres: Rin SMILES atom order

Hazards

Danger

H302 Harmful if swallowedAcute toxicity, oral
H351 Suspected of causing cancerCarcinogenicity
H360D May damage the unborn childReproductive toxicity
H411 Toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 616-223-00-7), via PubChem.

Precautionary statements

P203, P264, P270, P273, P280, P301+P317, P318, P330, P391, P405, P501

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

Weigh it out

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

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 N-Carbobenzyloxyalanine1142-20-736 % 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