4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide

C11H6F4N2O2 — CID 55131451

IUPAC4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide
SMILESO=C(Nc1ccon1)c1ccc(F)c(C(F)(F)F)c1
InChIInChI=1S/C11H6F4N2O2/c12-8-2-1-6(5-7(8)11(13,14)15)10(18)16-9-3-4-19-17-9/h1-5H,(H,16,17,18)
InChIKeyWSZJXZFQODPJDC-UHFFFAOYSA-N
MW274.17 g/mol
LogP3.08
Rot. Bonds2

About 4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide

4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide (PubChem CID 55131451) has the molecular formula C11H6F4N2O2 and a molecular weight of 274.17 g/mol. Its IUPAC name is 4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide
PubChem CID55131451
Molecular FormulaC11H6F4N2O2
Molecular Weight274.17 g/mol
Exact Mass274.04
IUPAC Name4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide
SMILESO=C(Nc1ccon1)c1ccc(F)c(C(F)(F)F)c1
InChIInChI=1S/C11H6F4N2O2/c12-8-2-1-6(5-7(8)11(13,14)15)10(18)16-9-3-4-19-17-9/h1-5H,(H,16,17,18)
InChIKeyWSZJXZFQODPJDC-UHFFFAOYSA-N
XLogP3.08
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.17
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-N-pyridazin-3-yl-3-(trifluoromethyl)benzamide
CID 115635769
4-fluoro-N-[4-methyl-3-(trifluoromethyl)phenyl]-3-(trifluoromethyl)benzamide
CID 118641910
3,5-dichloro-N-(1,2-oxazol-3-yl)benzamide
CID 17249127
4-amino-3-methyl-N-(1,2-oxazol-3-yl)benzamide
CID 62903600
3,4-dimethoxy-N-(1,2-oxazol-3-yl)benzamide
CID 17217711
4-fluoro-N-(1,2,4-triazin-3-yl)-3-(trifluoromethyl)benzamide
CID 114387361
3-fluoro-4-(4-hydroxybut-1-ynyl)-N-(1,2-oxazol-3-yl)benzamide
CID 62904657
3-methyl-N-(1,2-oxazol-3-yl)benzamide
CID 17217691
1-(1,2-oxazol-3-yl)-3-[2-(trifluoromethyl)phenyl]urea
CID 971367
3-hydroxy-4-methoxy-N-(1,2-oxazol-3-yl)benzamide
CID 79725967
N-(1,2-oxazol-3-yl)-1H-indole-6-carboxamide
CID 63768269
4-fluoro-N-(2-oxopropyl)-3-(trifluoromethyl)benzamide
CID 64996833

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide?
The IUPAC name of 4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide (CID 55131451) is 4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide.
What is the SMILES notation for 4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide?
The canonical SMILES for 4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide is O=C(Nc1ccon1)c1ccc(F)c(C(F)(F)F)c1.
What is the InChIKey of 4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide?
The InChIKey is WSZJXZFQODPJDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6F4N2O2/c12-8-2-1-6(5-7(8)11(13,14)15)10(18)16-9-3-4-19-17-9/h1-5H,(H,16,17,18).
What are the key properties of 4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide?
4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide has a molecular weight of 274.17 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(1,2-oxazol-3-yl)-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 55131451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).