Basic information
- Standard SMILES
CC(C)CCNC(=O)Cn1cccc(NC(=O)OCc2ccccc2)c1=O- InChIKey
GANQVWJUKVSQLZ-UHFFFAOYSA-N- Molecular formula
- C20H25N3O4
- Average molar mass
- 371.4 g/mol
Names & identifiers
- Preferred name
- Benzyl 1-(2-(isopentylamino)-2-oxoethyl)-2-oxo-1,2-dihydropyridin-3-ylcarbamate
- IUPAC
- benzyl N-[1-[2-(3-methylbutylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]carbamate
Names & synonyms
SCHEMBL15418794GANQVWJUKVSQLZ-UHFFFAOYSA-NNSC763741NSC-763741Benzyl 1-(2-(isopentylamino)-2-oxoethyl)-2-oxo-1,2-dihydropyridin-3-ylcarbamate
Database identifiers
- PubChem CID
- 89926023
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 87.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 592
Related reactions
2 records
Compound notes
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