5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinolin-7-yl dimethylcarbamate
Basic information
- CAS
380632-35-9- Standard SMILES
CN(C)C(=O)Oc1cc(=O)n2c3c(cccc13)CCC2- InChIKey
KHXJPBWSTXHEHN-UHFFFAOYSA-N- Molecular formula
- C15H16N2O3
- Average molar mass
- 272.3 g/mol
- Monoisotopic mass
- 272.11609238
Names & identifiers
- Preferred name
- 5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinolin-7-yl dimethylcarbamate
- IUPAC
- (2-oxo-1-azatricyclo[7.3.1.05,13]trideca-3,5,7,9(13)-tetraen-4-yl) N,N-dimethylcarbamate
Names & synonyms
5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinolin-7-yl dimethylcarbamate380632-35-9AE-406/41056520MLS000701911CHEMBL1470850DTXSID70356501HMS2522C13(2-oxo-1-azatricyclo[7.3.1.05,13]trideca-3,5,7,9(13)-tetraen-4-yl) N,N-dimethylcarbamateSMR000224686
Database identifiers
- CAS
380632-35-9- PubChem CID
- 825040
- DTXSID
DTXSID70356501- ChEMBL
CHEMBL1470850
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 458
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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