Basic information
- Standard SMILES
CCCCCCCCCCNC(=O)C=Cc1cccc(N2CC(C(=O)OCCN(CC)CC)CC2=O)c1- InChIKey
HHUBJSROKXUHFE-UHFFFAOYSA-N- Molecular formula
- C30H47N3O4
- Average molar mass
- 513.7 g/mol
Names & identifiers
- Preferred name
- N-Decyl-3-(3-[4-(2-[N,N-diethylamino]ethoxycarbonyl)-2-oxo-pyrrolidino]phenyl)propenamide
- IUPAC
- 2-(diethylamino)ethyl 1-[3-[3-(decylamino)-3-oxoprop-1-enyl]phenyl]-5-oxopyrrolidine-3-carboxylate
Names & synonyms
SCHEMBL11098352HHUBJSROKXUHFE-UHFFFAOYSA-NN-Decyl-3-(3-[4-(2-[N,N-diethylamino]ethoxycarbonyl)-2-oxo-pyrrolidino]phenyl)propenamide
Database identifiers
- PubChem CID
- 53877985
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 79 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 19
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 707
Related reactions
2 records
Compound notes
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