2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide

C12H9F3N2O2 — CID 110686374

IUPAC2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1cocn1)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C12H9F3N2O2/c13-12(14,15)8-2-1-3-9(4-8)17-11(18)5-10-6-19-7-16-10/h1-4,6-7H,5H2,(H,17,18)
InChIKeyUEMFLCLPZCCDNW-UHFFFAOYSA-N
MW270.21 g/mol
LogP2.87
Rot. Bonds3

About 2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide

2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide (PubChem CID 110686374) has the molecular formula C12H9F3N2O2 and a molecular weight of 270.21 g/mol. Its IUPAC name is 2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
PubChem CID110686374
Molecular FormulaC12H9F3N2O2
Molecular Weight270.21 g/mol
Exact Mass270.06
IUPAC Name2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1cocn1)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C12H9F3N2O2/c13-12(14,15)8-2-1-3-9(4-8)17-11(18)5-10-6-19-7-16-10/h1-4,6-7H,5H2,(H,17,18)
InChIKeyUEMFLCLPZCCDNW-UHFFFAOYSA-N
XLogP2.87
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.21
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-bis[3-(trifluoromethyl)phenyl]hexanediamide
CID 5058568
CID 89006052
CID 89006052
[[4-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]-1,3-thiazol-2-yl]amino] acetate
CID 21321153
2-(4-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 2666418
lithium 3-oxo-3-[3-(trifluoromethyl)anilino]propanoate
CID 23693664
N'-[3-(trifluoromethyl)phenyl]-N-[4-(trifluoromethyl)phenyl]propanediamide
CID 108956063
2-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]pyrazole-3-carboxylic acid
CID 19482774
2-[4-(benzimidazol-1-yl)phenyl]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 67021639
2-[2-(methylcarbamoylamino)-1,3-thiazol-4-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 21321154
3-[3-oxo-3-[3-(trifluoromethyl)anilino]propyl]sulfanyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 3619896
2-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 7668155
N-(3,4-difluorophenyl)-N'-[3-(trifluoromethyl)phenyl]propanediamide
CID 108956092

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide (CID 110686374) is 2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide is O=C(Cc1cocn1)Nc1cccc(C(F)(F)F)c1.
What is the InChIKey of 2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide?
The InChIKey is UEMFLCLPZCCDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F3N2O2/c13-12(14,15)8-2-1-3-9(4-8)17-11(18)5-10-6-19-7-16-10/h1-4,6-7H,5H2,(H,17,18).
What are the key properties of 2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide?
2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide has a molecular weight of 270.21 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-oxazol-4-yl)-N-[3-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 110686374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).