5-Bromo-N-((1SR,2RS)-2-hydroxy-cyclohexyl)-6-(2,2,2-trifluoro-ethoxy)-nicotinamide

HCID 58192591
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Basic information

Standard SMILES
O=C(NC1CCCCC1O)c1cnc(OCC(F)(F)F)c(Br)c1
InChIKey
QWZWIONZGGXEJX-UHFFFAOYSA-N
Molecular formula
C14H16BrF3N2O3
Average molar mass
397.19 g/mol

Names & identifiers

Preferred name
5-Bromo-N-((1SR,2RS)-2-hydroxy-cyclohexyl)-6-(2,2,2-trifluoro-ethoxy)-nicotinamide
IUPAC
5-bromo-N-(2-hydroxycyclohexyl)-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide

Names & synonyms

5-Bromo-N-((1SR,2RS)-2-hydroxy-cyclohexyl)-6-(2,2,2-trifluoro-ethoxy)-nicotinamideSCHEMBL6527450

Database identifiers

PubChem CID
58192591

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
71.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
23

Related reactions

5 records
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Linked notes

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