2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide

C18H13F3N4O3 — CID 109093173

IUPAC2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide
SMILESCc1cc(NC(=O)c2cc(C(=O)Nc3ccccc3C(F)(F)F)ccn2)no1
InChIInChI=1S/C18H13F3N4O3/c1-10-8-15(25-28-10)24-17(27)14-9-11(6-7-22-14)16(26)23-13-5-3-2-4-12(13)18(19,20)21/h2-9H,1H3,(H,23,26)(H,24,25,27)
InChIKeyBOUJTJCFEDSSOZ-UHFFFAOYSA-N
MW390.32 g/mol
LogP3.90
Rot. Bonds4

About 2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide

2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide (PubChem CID 109093173) has the molecular formula C18H13F3N4O3 and a molecular weight of 390.32 g/mol. Its IUPAC name is 2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide
PubChem CID109093173
Molecular FormulaC18H13F3N4O3
Molecular Weight390.32 g/mol
Exact Mass390.09
IUPAC Name2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide
SMILESCc1cc(NC(=O)c2cc(C(=O)Nc3ccccc3C(F)(F)F)ccn2)no1
InChIInChI=1S/C18H13F3N4O3/c1-10-8-15(25-28-10)24-17(27)14-9-11(6-7-22-14)16(26)23-13-5-3-2-4-12(13)18(19,20)21/h2-9H,1H3,(H,23,26)(H,24,25,27)
InChIKeyBOUJTJCFEDSSOZ-UHFFFAOYSA-N
XLogP3.90
TPSA97.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.32
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-(2-methylphenyl)-2-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide
CID 109091026
2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide
CID 109093313
4-N-(3-chloro-2-methylphenyl)-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
CID 109092904
4-N-(5-methyl-1,2-oxazol-3-yl)-2-N-[3-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide
CID 109093176
4-N-(5-methyl-1,2-oxazol-3-yl)-2-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085674
N-(5-methyl-1,2-oxazol-3-yl)-5-[2-(trifluoromethyl)anilino]pyrazine-2-carboxamide
CID 109293991
4-N-[(2-chlorophenyl)methyl]-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
CID 109086668
4-N-(4-acetamidophenyl)-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
CID 109093229
2-N-butyl-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide
CID 109079504
2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109087205
4-N-(2,4-dimethoxyphenyl)-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
CID 109093166
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-4-carboxamide
CID 109178911

Frequently Asked Questions

What is the IUPAC name of 2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide (CID 109093173) is 2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide is Cc1cc(NC(=O)c2cc(C(=O)Nc3ccccc3C(F)(F)F)ccn2)no1.
What is the InChIKey of 2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide?
The InChIKey is BOUJTJCFEDSSOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F3N4O3/c1-10-8-15(25-28-10)24-17(27)14-9-11(6-7-22-14)16(26)23-13-5-3-2-4-12(13)18(19,20)21/h2-9H,1H3,(H,23,26)(H,24,25,27).
What are the key properties of 2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide?
2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide has a molecular weight of 390.32 g/mol, XLogP of 3.90, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109093173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).