Basic information
- Standard SMILES
CC1C(Oc2ccc(C(F)(F)F)cn2)=CC=CC1=C1CCNCC1.Cl- InChIKey
DKCMKTUTMGBQHQ-UHFFFAOYSA-N- Molecular formula
- C18H20ClF3N2O
- Average molar mass
- 372.8 g/mol
Names & identifiers
- Preferred name
- 2-(3-Piperidin-4-ylidene-methyl-phenoxy)-5-trifluoromethyl-pyridine hydrochloride
- IUPAC
- 2-(6-methyl-5-piperidin-4-ylidenecyclohexa-1,3-dien-1-yl)oxy-5-(trifluoromethyl)pyridine;hydrochloride
Names & synonyms
2-(3-piperidin-4-ylidene-methyl-phenoxy)-5-trifluoromethyl-pyridine hydrochlorideSCHEMBL1012004
Database identifiers
- PubChem CID
- 66876356
Properties
Computed structural properties
- Topological polar surface area
- 34.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 543
Related reactions
4 records
Compound notes
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