(6aR,9R,10aR)-4,7,9-trimethyl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline
Basic information
- CAS
81967-87-5- Standard SMILES
C[C@@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1- InChIKey
ADPVUBKUMMKOKD-DJSGYFEHSA-N- Molecular formula
- C17H22N2
- Average molar mass
- 254.37 g/mol
- Monoisotopic mass
- 254.17829871
Names & identifiers
- Preferred name
- (6aR,9R,10aR)-4,7,9-trimethyl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline
- IUPAC
- (6aR,9R,10aR)-4,7,9-trimethyl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline
Names & synonyms
NSC332293NSC-332293
Database identifiers
- CAS
81967-87-5- PubChem CID
- 332853
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 8.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 355
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Compound notes
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