[2-(Dimethylaminophenyl-methyl)cyclohexyl]4-trifluoromethylbenzoate
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Basic information
- Standard SMILES
CN(C)C(c1ccccc1)C1CCCCC1OC(=O)c1ccc(C(F)(F)F)cc1- InChIKey
RVCDIGZZCIKTFM-UHFFFAOYSA-N- Molecular formula
- C23H26F3NO2
- Average molar mass
- 405.5 g/mol
- Monoisotopic mass
- 405.19156356
Names & identifiers
- Preferred name
- [2-(Dimethylaminophenyl-methyl)cyclohexyl]4-trifluoromethylbenzoate
- IUPAC
- [2-[dimethylamino(phenyl)methyl]cyclohexyl] 4-(trifluoromethyl)benzoate
Names & synonyms
[2-(dimethylaminophenyl-methyl)cyclohexyl]4-trifluoromethylbenzoateSCHEMBL6564303[2-(dimethylaminophenyl-methyl) cyclohexyl]4-trifluoromethylbenzoate
Database identifiers
- PubChem CID
- 9846162
Properties
Computed structural propertiesFilling in
- XLogP
- 5.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 523
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Related reactions
2 records
Compound notes
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