Acetamide, N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-
Basic information
- CAS
39113-16-1- Standard SMILES
CC(=O)NN1Cc2ccccc2CC1=O- InChIKey
KZEJQPGHFLYWOJ-UHFFFAOYSA-N- Molecular formula
- C11H12N2O2
- Average molar mass
- 204.22 g/mol
- Monoisotopic mass
- 204.08987763
Names & identifiers
- Preferred name
- Acetamide, N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-
- IUPAC
- N-(3-oxo-1,4-dihydroisoquinolin-2-yl)acetamide
Names & synonyms
BRN 1466622Acetamide, N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-N-(3-Oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)acetamideAcetamide, N-(3,4-dihydro-3-oxo-2(1H)-isoquinolinyl)-39113-16-1DTXSID90192362RefChem:315204DTXCID00114853n-(3-oxo-3,4-dihydroisoquinolin-2(1h)-yl)acetamide
Database identifiers
- CAS
39113-16-1- PubChem CID
- 217642
- DTXSID
DTXSID90192362- Nikkaji
- J74.911G
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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