5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide

C15H15F3N2O3 — CID 8001215

IUPAC5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide
SMILESCCCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(C)on1
InChIInChI=1S/C15H15F3N2O3/c1-3-6-22-13-5-4-10(15(16,17)18)8-11(13)19-14(21)12-7-9(2)23-20-12/h4-5,7-8H,3,6H2,1-2H3,(H,19,21)
InChIKeyMMFHDYOFVMIVQC-UHFFFAOYSA-N
MW328.29 g/mol
LogP4.04
Rot. Bonds5

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

5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide (PubChem CID 8001215) has the molecular formula C15H15F3N2O3 and a molecular weight of 328.29 g/mol. Its IUPAC name is 5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide
PubChem CID8001215
Molecular FormulaC15H15F3N2O3
Molecular Weight328.29 g/mol
Exact Mass328.10
IUPAC Name5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide
SMILESCCCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(C)on1
InChIInChI=1S/C15H15F3N2O3/c1-3-6-22-13-5-4-10(15(16,17)18)8-11(13)19-14(21)12-7-9(2)23-20-12/h4-5,7-8H,3,6H2,1-2H3,(H,19,21)
InChIKeyMMFHDYOFVMIVQC-UHFFFAOYSA-N
XLogP4.04
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.29
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide 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 5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide (CID 8001215) is 5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide is CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(C)on1.
What is the InChIKey of 5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide?
The InChIKey is MMFHDYOFVMIVQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N2O3/c1-3-6-22-13-5-4-10(15(16,17)18)8-11(13)19-14(21)12-7-9(2)23-20-12/h4-5,7-8H,3,6H2,1-2H3,(H,19,21).
What are the key properties of 5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide?
5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide has a molecular weight of 328.29 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 8001215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).