chempirical

Brivaracetam

C11H20N2O2CAS 357336-20-0212.29 g/mol

Open in Covalent MOL file
ONH2NO
AmideLactam

Properties

Molecular formula
C11H20N2O2
Molar mass
212.29 g/mol
Exact mass
212.1525 Da
logP
1.95Crippen estimate
Polar surface area
64.4 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
5
Stereocentres
R, Sin SMILES atom order

Hazards

Warning
Irritant (GHS07)

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P301+P317, P304+P340, P319, P330, P403+P233, P405, P501

Identifiers

CAS number
357336-20-0
SMILES
CCC[C@@H]1CC(=O)N([C@@H](CC)C(=N)O)C1
InChIKey
MSYKRHVOOPPJKU-BDAKNGLRSA-N
InChI
InChI=1S/C11H20N2O2/c1-3-5-8-6-10(14)13(7-8)9(4-2)11(12)15/h8-9H,3-7H2,1-2H3,(H2,12,15)/t8-,9+/m1/s1

Weigh it out

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

Names and synonyms

6 names
  • 1-Pyrrolidineacetamide, α-ethyl-2-oxo-4-propyl-, (αS,4R)-
  • (αS,4R)-α-Ethyl-2-oxo-4-propyl-1-pyrrolidineacetamide
  • UCB 34714
  • Briviact
  • 1-Pyrrolidineacetamide α-ethyl-2-oxo-4-propyl-, (αS,4R)-
  • (2S)-2-[(4R)-2-Oxo-4-propyl-1-pyrrolidinyl]butanamide

Work with Brivaracetam

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

Levetiracetam102767-28-253 % similar Alpha-ethyl-2-oxo-1-Pyrrolidineacetamide33996-58-653 % similar Valpromide2430-27-539 % similar 4-Ethyloctanoic acid16493-80-435 % similar 1,1-Dimethylethyl (2S)-2-(aminocarbonyl)-1-pyrrolidinecarboxylate35150-07-335 % similar (αS)-α-Ethyl-2-oxo-1-pyrrolidineacetic acid102849-49-034 % similar Levetiracetam acid103833-72-334 % similar Rhodium(III) 2-ethylhexanoate20845-92-533 % similar

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

Same formula

tert-Butyl 6-amino-2-azaspiro[3.3]heptane-2-carboxylate1211586-09-2 tert-Butyl (7R)-5-azaspiro(2.4)heptan-7-ylcarbamate127199-44-4 (S)-tert-Butyl 5-azaspiro[2.4]heptan-7-ylcarbamate127199-45-5 tert-Butyl octahydropyrrolo(3,4-c)pyrrole-2-carboxylate141449-85-6 tert-Butyl 3,8-diazabicyclo[3.2.1]octane-8-carboxylate149771-44-8 Hexahydro-pyrrolo[3,4-B]pyrrole-1-carboxylic acid tert-butyl ester185693-02-1 1,1-Dimethylethyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate201162-53-0 cis-2-Boc-hexahydropyrrolo[3,4-C]pyrrole250275-15-1

Elsewhere

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