5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide

C14H9F4NO3 — CID 155535033

IUPAC5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide
SMILESO=C(Nc1cccc(OC(F)(F)F)c1)c1cc(F)ccc1O
InChIInChI=1S/C14H9F4NO3/c15-8-4-5-12(20)11(6-8)13(21)19-9-2-1-3-10(7-9)22-14(16,17)18/h1-7,20H,(H,19,21)
InChIKeyNPLLAIOKBLFALN-UHFFFAOYSA-N
MW315.22 g/mol
LogP3.68
Rot. Bonds3

About 5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide

5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide (PubChem CID 155535033) has the molecular formula C14H9F4NO3 and a molecular weight of 315.22 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide
PubChem CID155535033
Molecular FormulaC14H9F4NO3
Molecular Weight315.22 g/mol
Exact Mass315.05
IUPAC Name5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide
SMILESO=C(Nc1cccc(OC(F)(F)F)c1)c1cc(F)ccc1O
InChIInChI=1S/C14H9F4NO3/c15-8-4-5-12(20)11(6-8)13(21)19-9-2-1-3-10(7-9)22-14(16,17)18/h1-7,20H,(H,19,21)
InChIKeyNPLLAIOKBLFALN-UHFFFAOYSA-N
XLogP3.68
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.22
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide
CID 71459065
2-hydroxy-4-methoxy-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 38204734
2,3-dihydroxy-5-methyl-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 59014806
2-chloro-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 38257874
2,2,2-trifluoro-N-[3-(trifluoromethoxy)phenyl]acetamide
CID 62489908
2,4-dimethyl-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 38032669
N-(3-ethynylphenyl)-5-fluoro-2-hydroxybenzamide
CID 79532349
N-[3-(bromomethyl)phenyl]-5-fluoro-2-hydroxybenzamide
CID 115299606
N-(3-carbamothioylphenyl)-5-fluoro-2-hydroxybenzamide
CID 115298712
5-bromo-2-iodo-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 38034888
2,2-dimethyl-N-[3-(trifluoromethoxy)phenyl]propanamide
CID 60725225
5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide
CID 115299348

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide (CID 155535033) is 5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide is O=C(Nc1cccc(OC(F)(F)F)c1)c1cc(F)ccc1O.
What is the InChIKey of 5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide?
The InChIKey is NPLLAIOKBLFALN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F4NO3/c15-8-4-5-12(20)11(6-8)13(21)19-9-2-1-3-10(7-9)22-14(16,17)18/h1-7,20H,(H,19,21).
What are the key properties of 5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide?
5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide has a molecular weight of 315.22 g/mol, XLogP of 3.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydroxy-N-[3-(trifluoromethoxy)phenyl]benzamide is sourced from PubChem (CID 155535033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).