2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide

C17H19F3N2O2 — CID 84575416

IUPAC2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESCc1nc(C(C)(C)C)oc1CC(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C17H19F3N2O2/c1-10-13(24-15(21-10)16(2,3)4)9-14(23)22-12-7-5-11(6-8-12)17(18,19)20/h5-8H,9H2,1-4H3,(H,22,23)
InChIKeySNWDWHKFXUKBRT-UHFFFAOYSA-N
MW340.35 g/mol
LogP4.48
Rot. Bonds3

About 2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide

2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 84575416) has the molecular formula C17H19F3N2O2 and a molecular weight of 340.35 g/mol. Its IUPAC name is 2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID84575416
Molecular FormulaC17H19F3N2O2
Molecular Weight340.35 g/mol
Exact Mass340.14
IUPAC Name2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESCc1nc(C(C)(C)C)oc1CC(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C17H19F3N2O2/c1-10-13(24-15(21-10)16(2,3)4)9-14(23)22-12-7-5-11(6-8-12)17(18,19)20/h5-8H,9H2,1-4H3,(H,22,23)
InChIKeySNWDWHKFXUKBRT-UHFFFAOYSA-N
XLogP4.48
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-(4-chlorophenyl)acetamide
CID 84576925
2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-pyridin-2-ylacetamide
CID 84576085
N-(4-acetamidophenyl)-2-(2,4-dimethyl-1,3-oxazol-5-yl)acetamide
CID 110680155
N-(4-bromophenyl)-2-(2,4-dimethyl-1,3-oxazol-5-yl)acetamide
CID 110680134
N-benzhydryl-2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)acetamide
CID 84576768
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(2,4-dimethyl-1,3-oxazol-5-yl)acetamide
CID 110680187
N-(4-acetamidophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 51271866
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 135896930
2-methyl-2-[4-[[2-[4-(trifluoromethyl)phenyl]acetyl]amino]phenyl]propanoic acid
CID 119253975
2,2-dimethyl-N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]propanamide
CID 771812
2-(4-hydroxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 14879849
3,3-dimethyl-N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]butanamide
CID 60565839

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide (CID 84575416) is 2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide is Cc1nc(C(C)(C)C)oc1CC(=O)Nc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is SNWDWHKFXUKBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19F3N2O2/c1-10-13(24-15(21-10)16(2,3)4)9-14(23)22-12-7-5-11(6-8-12)17(18,19)20/h5-8H,9H2,1-4H3,(H,22,23).
What are the key properties of 2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide?
2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 340.35 g/mol, XLogP of 4.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butyl-4-methyl-1,3-oxazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 84575416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).