Basic information
- Standard SMILES
CN1CC(=O)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21- InChIKey
WZWHHCYTJDBJPY-TZMCWYRMSA-N- Molecular formula
- C15H16N2O
- Average molar mass
- 240.3 g/mol
Names & identifiers
- Preferred name
- 6-Methyl-8-oxo-ergoline
- IUPAC
- (6aR,10aR)-7-methyl-4,6,6a,8,10,10a-hexahydroindolo[4,3-fg]quinolin-9-one
Names & synonyms
6-methyl-8-oxo-ergolineSCHEMBL10506987WZWHHCYTJDBJPY-TZMCWYRMSA-N
Database identifiers
- PubChem CID
- 11622829
- Nikkaji
- J2.263.618I
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 36.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 370
Related reactions
6 records
Compound notes
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