Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(O)(c2cc(C(F)(F)F)ccn2)CC1- InChIKey
MCVWQIWIIAVZFU-UHFFFAOYSA-N- Molecular formula
- C16H21F3N2O3
- Average molar mass
- 346.34 g/mol
Names & identifiers
- Preferred name
- tert-Butyl4-hydroxy-4-[4-(trifluoromethyl)pyridin-2-yl]piperidine-1-carboxylate
- IUPAC
- tert-butyl 4-hydroxy-4-[4-(trifluoromethyl)-2-pyridinyl]piperidine-1-carboxylate
Names & synonyms
tert-Butyl4-hydroxy-4-[4-(trifluoromethyl)pyridin-2-yl]piperidine-1-carboxylateSCHEMBL3327490tert-butyl 4-hydroxy-4-[4-(trifluoromethyl)pyridin-2-yl]piperidine-1-carboxylate
Database identifiers
- PubChem CID
- 59833581
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 454
Related reactions
9 records
Compound notes
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