N-(4-(trifluoromethyl)-2-(piperidin-1-yl)benzyl)-2,3-dihydro-2-oxobenzo[d]oxazole-4-carboxamide
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Basic information
- Standard SMILES
O=C(NCc1ccc(C(F)(F)F)cc1N1CCCCC1)c1cccc2oc(=O)[nH]c12- InChIKey
GVOGMMQHGUVEMI-UHFFFAOYSA-N- Molecular formula
- C21H20F3N3O3
- Average molar mass
- 419.4 g/mol
Names & identifiers
- Preferred name
- N-(4-(trifluoromethyl)-2-(piperidin-1-yl)benzyl)-2,3-dihydro-2-oxobenzo[d]oxazole-4-carboxamide
- IUPAC
- 2-oxo-N-[[2-piperidin-1-yl-4-(trifluoromethyl)phenyl]methyl]-3H-1,3-benzoxazole-4-carboxamide
Names & synonyms
N-(4-(trifluoromethyl)-2-(piperidin-1-yl)benzyl)-2,3-dihydro-2-oxobenzo[d]oxazole-4-carboxamideSCHEMBL2481333
Database identifiers
- PubChem CID
- 53476934
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 70.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 639
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Related reactions
1 records
Compound notes
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