Basic information
- Standard SMILES
COC(=O)[C@H](CC1CCCCC1)N1CC(OC)=CC1=O- InChIKey
WIDFTMOBHVRRMV-ZDUSSCGKSA-N- Molecular formula
- C15H23NO4
- Average molar mass
- 281.35 g/mol
Names & identifiers
- Preferred name
- (S)-3-cyclohexyl-2-(4-methoxy-2-oxo-2,5-dihydro-pyrrol-1-yl)-propionic acid methyl ester
- IUPAC
- methyl (2S)-3-cyclohexyl-2-(3-methoxy-5-oxo-2H-pyrrol-1-yl)propanoate
Names & synonyms
SCHEMBL1069552WIDFTMOBHVRRMV-ZDUSSCGKSA-N(S)-3-cyclohexyl-2-(4-methoxy-2-oxo-2,5-dihydro-pyrrol-1-yl)-propionic acid methyl ester
Database identifiers
- PubChem CID
- 66895604
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 399
Related reactions
2 records
Compound notes
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