chempirical

4-Phenyl-2-pyrrolidinone

C10H11NOCAS 1198-97-6161.20 g/mol

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Properties

Molecular formula
C10H11NO
Molar mass
161.20 g/mol
Exact mass
161.0841 Da
Melting point
60 °C
Boiling point
198–200 °C (at 10 Torr)
logP
2.13Crippen estimate
Polar surface area
32.6 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
1198-97-6
SMILES
OC1=NCC(c2ccccc2)C1
InChIKey
HOJZEMQCQRPLQQ-UHFFFAOYSA-N
InChI
InChI=1S/C10H11NO/c12-10-6-9(7-11-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)

Weigh it out

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

Names and synonyms

4 names
  • 2-Pyrrolidinone, 4-phenyl-
  • β-Phenyl-γ-aminobutyric acid lactam
  • 4-Phenyl-2-pyrrolidone
  • 3-Phenyl-5-pyrrolidinone

Work with 4-Phenyl-2-pyrrolidinone

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

3-Phenylglutaric acid4165-96-247 % similar Rolipram61413-54-544 % similar 2-Phenyl-1,3-propanediol1570-95-242 % similar 2-Oxo-4-phenylpyrrolidine-1-acetic acid hydrazide77472-71-041 % similar Phenibut1078-21-341 % similar 4-Hydroxy-2-pyrrolidinone25747-41-541 % similar Felbamate25451-15-439 % similar Diphenylpropionic acid606-83-739 % similar

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

Same formula

5-Ethoxy-1H-indole10501-17-4 5-Methoxy-2-methylindole1076-74-0 1,2,3,4-Tetrahydro-benzo(b)azepin-5-one1127-74-8 N-Benzylacrylamide13304-62-6 3-(Methylphenylamino)-2-propenal14189-82-3 1-Acetylindoline16078-30-1 2,5,6-Trimethylbenzoxazole19219-98-8 4-Methoxybenzenepropanenitrile22442-48-4

Elsewhere

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