N-cyclohexyl-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Basic information
- CAS
2300-80-3- Standard SMILES
CN1CC(C(=O)NC2CCCCC2)CC2c3cccc4[nH]cc(c34)CC21- InChIKey
KOFNTRSDRGFTGZ-UHFFFAOYSA-N- Molecular formula
- C22H29N3O
- Average molar mass
- 351.5 g/mol
- Monoisotopic mass
- 351.23106256
Names & identifiers
- Preferred name
- N-cyclohexyl-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
- IUPAC
- N-cyclohexyl-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Names & synonyms
NSC1694862300-80-3DTXSID90305157NSC-169486N-Cyclohexyl-6-methylergoline-8-carboxamide
Database identifiers
- CAS
2300-80-3- PubChem CID
- 297950
- DTXSID
DTXSID90305157
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 531
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…