Basic information
- Standard SMILES
CC(C)(C)Oc1nccnc1CN1CCC(C(=O)Cc2ccccc2C(F)(F)F)CC1- InChIKey
PAPAPWIBUYCUHD-UHFFFAOYSA-N- Molecular formula
- C23H28F3N3O2
- Average molar mass
- 435.5 g/mol
Names & identifiers
- Preferred name
- 1-[1-(3-Tert-butoxy-2-pyrazinylmethyl)piperidin-4-yl]-2-[2-(trifluoromethyl)phenyl]ethanone
- IUPAC
- 1-[1-[[3-[(2-methylpropan-2-yl)oxy]pyrazin-2-yl]methyl]piperidin-4-yl]-2-[2-(trifluoromethyl)phenyl]ethanone
Names & synonyms
1-[1-(3-tert-butoxy-2-pyrazinylmethyl)piperidin-4-yl]-2-[2-(trifluoromethyl)phenyl]ethanoneSCHEMBL1474948
Database identifiers
- PubChem CID
- 22248487
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 55.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 586
Related reactions
8 records
Compound notes
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