Basic information
- Standard SMILES
Cc1cncc(NC(=O)N2CCC(=Cc3cccc(Oc4ccc(C(F)(F)F)cn4)c3)CC2)c1- InChIKey
IVGOYEHCBQPHAP-UHFFFAOYSA-N- Molecular formula
- C25H23F3N4O2
- Average molar mass
- 468.5 g/mol
- Monoisotopic mass
- 468.17731048
Names & identifiers
- Preferred name
- N-(5-methylpyridin-3-yl)-4-(3-{[5-(trifluoromethyl)pyridin-2-yl]oxy}benzylidene)piperidine-1-carboxamide
- IUPAC
- N-(5-methyl-3-pyridinyl)-4-[[3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methylidene]piperidine-1-carboxamide
Names & synonyms
N-(5-methylpyridin-3-yl)-4-(3-{[5-(trifluoromethyl)pyridin-2-yl]oxy}benzylidene)piperidine-1-carboxamideSCHEMBL1011155
Database identifiers
- PubChem CID
- 24967993
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 707
Related reactions
2 records
Compound notes
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