Basic information
- Standard SMILES
Cc1ocnc1C(=O)Nc1cnc(OCC(F)(F)F)c(C2CCCCC2)c1- InChIKey
YOHPMULIZILRIL-UHFFFAOYSA-N- Molecular formula
- C18H20F3N3O3
- Average molar mass
- 383.4 g/mol
- Monoisotopic mass
- 383.14567599
Names & identifiers
- Preferred name
- 5-Methyl-oxazole-4-carboxylic acid [5-cyclohexyl-6-(2,2,2-trifluoro-ethoxy)-pyridin-3-yl]-amide
- IUPAC
- N-[5-cyclohexyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-5-methyl-1,3-oxazole-4-carboxamide
Names & synonyms
5-methyl-oxazole-4-carboxylic acid [5-cyclohexyl-6-(2,2,2-trifluoro-ethoxy)-pyridin-3-yl]-amideSCHEMBL14773865
Database identifiers
- PubChem CID
- 71509737
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 77.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 500
Related reactions
2 records
Compound notes
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