7,5-(Epoxymethano)-1H-cyclopent[cd]indol-9-ol, decahydro-1,7b-dimethyl-6-(1-methylethyl)-, (2aS,4aS,5R,6S,7R,7aS,7bR)-
Basic information
- CAS
29370-27-2- Standard SMILES
CC(C)C1C2OC(O)C1C1CCC3CN(C)C2C31C- InChIKey
IZRJUIVSOCZQEM-UHFFFAOYSA-N- Molecular formula
- C16H27NO2
- Average molar mass
- 265.39 g/mol
- Monoisotopic mass
- 265.2041791
Names & identifiers
- Preferred name
- 7,5-(Epoxymethano)-1H-cyclopent[cd]indol-9-ol, decahydro-1,7b-dimethyl-6-(1-methylethyl)-, (2aS,4aS,5R,6S,7R,7aS,7bR)-
- IUPAC
- 2,12-dimethyl-13-propan-2-yl-10-oxa-2-azatetracyclo[5.4.1.18,11.04,12]tridecan-9-ol
Names & synonyms
DTXSID70110551929370-27-27,5-(Epoxymethano)-1H-cyclopent[cd]indol-9-ol, decahydro-1,7b-dimethyl-6-(1-methylethyl)-, (2aS,4aS,5R,6S,7R,7aS,7bR)-
Database identifiers
- CAS
29370-27-2- PubChem CID
- 165367113
- DTXSID
DTXSID701105519
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 398
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…