Basic information
- Standard SMILES
CCOc1cc2c(=O)c(C#N)c[nH]c2cc1NC(C)=O- InChIKey
NIBJUVJLWSAEAU-UHFFFAOYSA-N- Molecular formula
- C14H13N3O3
- Average molar mass
- 271.27 g/mol
- Monoisotopic mass
- 271.09569129
Names & identifiers
- Preferred name
- N-(3-Cyano-6-ethoxy-1,4-dihydro-4-oxo-7-quinolinyl)-acetamide
- IUPAC
- N-(3-cyano-6-ethoxy-4-oxo-1H-quinolin-7-yl)acetamide
Names & synonyms
364793-97-5Acetamide, N-(3-cyano-6-ethoxy-1,4-dihydro-4-oxo-7-quinolinyl)-N-(3-CYANO-6-ETHOXY-1,4-DIHYDRO-4-OXO-7-QUINOLINYL)-ACETAMIDESCHEMBL5253466Acetamide,N-(3-cyano-6-ethoxy-1,4-dihydro-4-oxo-7-quinolinyl)-DB-371076
Database identifiers
- PubChem CID
- 23438017
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 91.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 491
Related reactions
1 records
Compound notes
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