Basic information
- Standard SMILES
CCCN1CCC[C@@H]2CCC(=O)C[C@@H]21- InChIKey
YTKLOWRSQNENCY-PWSUYJOCSA-N- Molecular formula
- C12H21NO
- Average molar mass
- 195.3 g/mol
Names & identifiers
- Preferred name
- cis-(+/-)-1-n-Propyl-7-oxodecahydroquinoline
- IUPAC
- (4aR,8aS)-1-propyl-2,3,4,4a,5,6,8,8a-octahydroquinolin-7-one
Names & synonyms
SCHEMBL9824110YTKLOWRSQNENCY-PWSUYJOCSA-Ncis-(+/-)-1-n-propyl-7-oxodecahydroquinoline
Database identifiers
- PubChem CID
- 67935530
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 214
Related reactions
2 records
Compound notes
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