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Basic information
- Standard SMILES
CC(O)C1(C(=O)NCc2cc(C(F)(F)F)ccc2OC(C)(C)C)CCC(O)C1- InChIKey
GLZBKTVMPQQUKN-UHFFFAOYSA-N- Molecular formula
- C20H28F3NO4
- Average molar mass
- 403.4 g/mol
Names & identifiers
- Preferred name
- N-[2-tert-butoxy-5-(trifluoromethyl)benzyl]-3-hydroxy-1-(1-hydroxyethyl)cyclopentanecarboxamide
- IUPAC
- 3-hydroxy-1-(1-hydroxyethyl)-N-[[2-[(2-methylpropan-2-yl)oxy]-5-(trifluoromethyl)phenyl]methyl]cyclopentane-1-carboxamide
Names & synonyms
N-[2-tert-butoxy-5-(trifluoromethyl)benzyl]-3-hydroxy-1-(1-hydroxyethyl)cyclopentanecarboxamideSCHEMBL3164000
Database identifiers
- PubChem CID
- 59261007
Properties
Computed structural propertiesFilling in
- XLogP
- 2.6
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 549
Related reactions
2 records
Compound notes
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