2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide

C15H10ClF3N4O3 — CID 57458485

IUPAC2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide
SMILESO=C(COc1cc(C(F)(F)F)nn1-c1ccccc1Cl)Nc1ccon1
InChIInChI=1S/C15H10ClF3N4O3/c16-9-3-1-2-4-10(9)23-14(7-11(21-23)15(17,18)19)25-8-13(24)20-12-5-6-26-22-12/h1-7H,8H2,(H,20,22,24)
InChIKeyMGFRHMKRPMVTKP-UHFFFAOYSA-N
MW386.72 g/mol
LogP3.55
Rot. Bonds5

About 2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide

2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide (PubChem CID 57458485) has the molecular formula C15H10ClF3N4O3 and a molecular weight of 386.72 g/mol. Its IUPAC name is 2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide
PubChem CID57458485
Molecular FormulaC15H10ClF3N4O3
Molecular Weight386.72 g/mol
Exact Mass386.04
IUPAC Name2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide
SMILESO=C(COc1cc(C(F)(F)F)nn1-c1ccccc1Cl)Nc1ccon1
InChIInChI=1S/C15H10ClF3N4O3/c16-9-3-1-2-4-10(9)23-14(7-11(21-23)15(17,18)19)25-8-13(24)20-12-5-6-26-22-12/h1-7H,8H2,(H,20,22,24)
InChIKeyMGFRHMKRPMVTKP-UHFFFAOYSA-N
XLogP3.55
TPSA82.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.72
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide (CID 57458485) is 2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide is O=C(COc1cc(C(F)(F)F)nn1-c1ccccc1Cl)Nc1ccon1.
What is the InChIKey of 2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide?
The InChIKey is MGFRHMKRPMVTKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClF3N4O3/c16-9-3-1-2-4-10(9)23-14(7-11(21-23)15(17,18)19)25-8-13(24)20-12-5-6-26-22-12/h1-7H,8H2,(H,20,22,24).
What are the key properties of 2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide?
2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide has a molecular weight of 386.72 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-chlorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-(1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 57458485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).