(S)-1-Benzyl-3-hydroxypyrrolidine-2,5-dione

C₁₁H₁₁NO₃CAS 101469-91-4205.21 g/mol

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Alcohol Amide Lactam

Properties

Molecular formula: C₁₁H₁₁NO₃
Molar mass: 205.21 g/mol
Exact mass: 205.0739 Da
logP: 0.31Crippen estimate
Polar surface area: 57.6 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

101469-91-4

SMILES

C1[C@@H](C(=O)N(C1=O)CC2=CC=CC=C2)O

InChIKey

VCPKAWKGCQTPCR-VIFPVBQESA-N

InChI

InChI=1S/C11H11NO3/c13-9-6-10(14)12(11(9)15)7-8-4-2-1-3-5-8/h1-5,9,13H,6-7H2/t9-/m0/s1

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Names and synonyms

1 names

N-Benzyl-(3S)-hydroxysuccinimide

Work with (S)-1-Benzyl-3-hydroxypyrrolidine-2,5-dione

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

5-Oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid5733-86-847 % similar 2-(Phenylmethyl)-1H-isoindole-1,3(2H)-dione2142-01-045 % similar Benzylmaleimide1631-26-144 % similar 5-Phenyl-1-(phenylmethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione72846-00-543 % similar (-)-3-Phenyllactic acid20312-36-141 % similar (+)-3-Phenyllactic acid7326-19-441 % similar (±)-3-Phenyllactic acid828-01-341 % similar (R)-2-Hydroxy-4-phenylbutyric acid29678-81-740 % similar

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

Same formula

Methyl 4-methoxy-1H-indole-2-carboxylate111258-23-2 Rel-(3R,4S)-3-(acetyloxy)-4-phenyl-2-azetidinone133066-59-8 6,7-Dimethoxy-4-hydroxyquinoline13425-93-9 (2Z)-4-Oxo-4-[(phenylmethyl)amino]-2-butenoic acid15329-69-8 Ethyl 5-aminobenzofuran-2-carboxylate174775-48-5 Indole-3-lactic acid1821-52-9 Ethyl 5-hydroxy-1H-indole-2-carboxylate24985-85-1 3-Cyano-4-(1-methylethoxy)benzoic acid258273-31-3

Elsewhere

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