Basic information
- CAS
87766-32-3- Standard SMILES
O=C1CC[C@@H](C(=O)NCc2ccccc2)N1- InChIKey
MDCKMKIRZIXFCH-JTQLQIEISA-N- Molecular formula
- C12H14N2O2
- Average molar mass
- 218.25 g/mol
- Monoisotopic mass
- 218.10552769
Overview
structure given in first source
Names & identifiers
- Preferred name
- Pyroglutamylbenzylamide
- IUPAC
- (2S)-N-benzyl-5-oxopyrrolidine-2-carboxamide
- English name
- pyroglutamylbenzylamide
- Molecular weight
- 0
Names & synonyms
PyroglutamylbenzylamidePyroglutamyl benzylamide87766-32-3DTXSID60236621RefChem:177851DTXCID90159112N-benzyl-5-oxo-L-prolinamideCHEMBL4633140SCHEMBL1162698MDCKMKIRZIXFCH-JTQLQIEISA-NBDBM506317982-Pyrrolidinecarboxamide, 5-oxo-N-(phenylmethyl)-, (S)-
Show more names
N-Benzyl-5-oxopyrrolidine-2α-carboxamide(S)-5-Oxo-N-(phenylmethyl)-2α-pyrrolidinecarboxamide
Database identifiers
- CAS
87766-32-3- PubChem CID
- 137348
- DTXSID
DTXSID60236621- ChEMBL
CHEMBL4633140- Nikkaji
- J261.793E
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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