Basic information
- CAS
2068137-93-7- Standard SMILES
O=C1CCN(C(=O)c2ccccc2)[C@@H]2CCCC[C@@H]12- InChIKey
HARZRCTWABIBKX-ZIAGYGMSSA-N- Molecular formula
- C16H19NO2
- Average molar mass
- 257.33 g/mol
- Monoisotopic mass
- 257.14157885
Names & identifiers
- Preferred name
- 4(1H)-Quinolinone, 1-benzoyloctahydro-, (4aR,8aR)-
- IUPAC
- (4aR,8aR)-1-benzoyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one
Names & synonyms
2068137-93-74(1H)-Quinolinone, 1-benzoyloctahydro-, (4aR,8aR)-RefChem:283693(trans)-1-benzoyloctahydroquinolin-4(1H)-one(4aR,8aR)-1-Benzoyloctahydroquinolin-4(1H)-one(4aR,8aR)-1-benzoyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-oneRel-(4aR,8aR)-1-benzoyloctahydroquinolin-4(1H)-one54924-15-1Oprea1_409654HARZRCTWABIBKX-ZIAGYGMSSA-NDTXSID501230041MFCD13372231
Show more names
STK7827831-benzoyl-trans-decahydro-4-quinoloneAKOS005619828CS-0331801(4aR,8aR)-1-(phenylcarbonyl)octahydroquinolin-4(1H)-one
Database identifiers
- CAS
2068137-93-7- PubChem CID
- 786137
- DTXSID
DTXSID501230041
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 360
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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