Basic information
- Standard SMILES
Nc1cc2c(cc1O)C1CC2CN(C(=O)C(F)(F)F)C1- InChIKey
SJMBJZCZGJENMN-UHFFFAOYSA-N- Molecular formula
- C13H13F3N2O2
- Average molar mass
- 286.25 g/mol
Names & identifiers
- Preferred name
- 2,2,2-Trifluoro-1-(4-hydroxy-5-amino-10-aza-tricyclo[6.3.1.02,7]dodeca-2(7), 3,5-trien-10-yl)-ethanone
- IUPAC
- 1-(4-amino-5-hydroxy-10-azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)-2,2,2-trifluoroethanone
Names & synonyms
2,2,2-Trifluoro-1-(4-hydroxy-5-amino-10-aza-tricyclo[6.3.1.02,7]dodeca-2(7), 3,5-trien-10-yl)-ethanoneSCHEMBL44070632,2,2-Trifluoro-1-(4-hydroxy-5-amino-10-aza-tricyclo[6.3.1.02,7]dodeca-2(7),3,5-trien-10-yl)-ethanone2,2,2-Trifluoro-1-(4-hydroxy-5-amino-10-aza-tricyclo[6.3.1.02,7]dodeca-2(7),3,5-trien-10yl)-ethanone2,2,2-Trifluoro-1-(4-hydroxy-5-amino-10-aza-tricyclo[6.3.1.02.7]dodeca-2(7),3,5-trien-10-yl)-ethanone2,2.2-trifluoro-1-(4-hydroxy-5-amino-10-aza-tricyclo[6.3.1.02.7]dodeca-2(7),3,5-trien-10-yl)-ethanone
Database identifiers
- PubChem CID
- 21864717
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 415
Related reactions
30 records
Linked notes
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