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

C20H17F3N2O2 — CID 34810970

IUPAC2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide
SMILESO=C(Cc1coc(-c2ccccc2)n1)NCCc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C20H17F3N2O2/c21-20(22,23)16-8-6-14(7-9-16)10-11-24-18(26)12-17-13-27-19(25-17)15-4-2-1-3-5-15/h1-9,13H,10-12H2,(H,24,26)
InChIKeyNKHJRFYWWWSQHJ-UHFFFAOYSA-N
MW374.36 g/mol
LogP4.26
Rot. Bonds6

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

2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide (PubChem CID 34810970) has the molecular formula C20H17F3N2O2 and a molecular weight of 374.36 g/mol. Its IUPAC name is 2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide.

Molecular Properties

Compound Name2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide
PubChem CID34810970
Molecular FormulaC20H17F3N2O2
Molecular Weight374.36 g/mol
Exact Mass374.12
IUPAC Name2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide
SMILESO=C(Cc1coc(-c2ccccc2)n1)NCCc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C20H17F3N2O2/c21-20(22,23)16-8-6-14(7-9-16)10-11-24-18(26)12-17-13-27-19(25-17)15-4-2-1-3-5-15/h1-9,13H,10-12H2,(H,24,26)
InChIKeyNKHJRFYWWWSQHJ-UHFFFAOYSA-N
XLogP4.26
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.36
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide?
The IUPAC name of 2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide (CID 34810970) is 2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide.
What is the SMILES notation for 2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide?
The canonical SMILES for 2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide is O=C(Cc1coc(-c2ccccc2)n1)NCCc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide?
The InChIKey is NKHJRFYWWWSQHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F3N2O2/c21-20(22,23)16-8-6-14(7-9-16)10-11-24-18(26)12-17-13-27-19(25-17)15-4-2-1-3-5-15/h1-9,13H,10-12H2,(H,24,26).
What are the key properties of 2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide?
2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide has a molecular weight of 374.36 g/mol, XLogP of 4.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide is sourced from PubChem (CID 34810970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).