3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide

C19H15F3N2O4 — CID 71802524

IUPAC3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide
SMILESO=C(NCc1ccccc1OC(F)(F)F)c1cc(OCc2ccccc2)no1
InChIInChI=1S/C19H15F3N2O4/c20-19(21,22)27-15-9-5-4-8-14(15)11-23-18(25)16-10-17(24-28-16)26-12-13-6-2-1-3-7-13/h1-10H,11-12H2,(H,23,25)
InChIKeySQTRSDBAUVCPOM-UHFFFAOYSA-N
MW392.33 g/mol
LogP4.08
Rot. Bonds7

About 3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide

3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide (PubChem CID 71802524) has the molecular formula C19H15F3N2O4 and a molecular weight of 392.33 g/mol. Its IUPAC name is 3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide
PubChem CID71802524
Molecular FormulaC19H15F3N2O4
Molecular Weight392.33 g/mol
Exact Mass392.10
IUPAC Name3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide
SMILESO=C(NCc1ccccc1OC(F)(F)F)c1cc(OCc2ccccc2)no1
InChIInChI=1S/C19H15F3N2O4/c20-19(21,22)27-15-9-5-4-8-14(15)11-23-18(25)16-10-17(24-28-16)26-12-13-6-2-1-3-7-13/h1-10H,11-12H2,(H,23,25)
InChIKeySQTRSDBAUVCPOM-UHFFFAOYSA-N
XLogP4.08
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.33
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide (CID 71802524) is 3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide is O=C(NCc1ccccc1OC(F)(F)F)c1cc(OCc2ccccc2)no1.
What is the InChIKey of 3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide?
The InChIKey is SQTRSDBAUVCPOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F3N2O4/c20-19(21,22)27-15-9-5-4-8-14(15)11-23-18(25)16-10-17(24-28-16)26-12-13-6-2-1-3-7-13/h1-10H,11-12H2,(H,23,25).
What are the key properties of 3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide?
3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide has a molecular weight of 392.33 g/mol, XLogP of 4.08, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenylmethoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 71802524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).