2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid

C17H11F3N4O4 — CID 154690739

IUPAC2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid
SMILESCc1noc(C)c1-c1cnn2ccc(-c3nc(C(F)(F)F)c(C(=O)O)o3)cc12
InChIInChI=1S/C17H11F3N4O4/c1-7-12(8(2)28-23-7)10-6-21-24-4-3-9(5-11(10)24)15-22-14(17(18,19)20)13(27-15)16(25)26/h3-6H,1-2H3,(H,25,26)
InChIKeyHCJDLOXAJYANJE-UHFFFAOYSA-N
MW392.29 g/mol
LogP3.98
Rot. Bonds3

About 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid

2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid (PubChem CID 154690739) has the molecular formula C17H11F3N4O4 and a molecular weight of 392.29 g/mol. Its IUPAC name is 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid.

Molecular Properties

Compound Name2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid
PubChem CID154690739
Molecular FormulaC17H11F3N4O4
Molecular Weight392.29 g/mol
Exact Mass392.07
IUPAC Name2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid
SMILESCc1noc(C)c1-c1cnn2ccc(-c3nc(C(F)(F)F)c(C(=O)O)o3)cc12
InChIInChI=1S/C17H11F3N4O4/c1-7-12(8(2)28-23-7)10-6-21-24-4-3-9(5-11(10)24)15-22-14(17(18,19)20)13(27-15)16(25)26/h3-6H,1-2H3,(H,25,26)
InChIKeyHCJDLOXAJYANJE-UHFFFAOYSA-N
XLogP3.98
TPSA106.66 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.29
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid 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-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid?
The IUPAC name of 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid (CID 154690739) is 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid.
What is the SMILES notation for 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid?
The canonical SMILES for 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid is Cc1noc(C)c1-c1cnn2ccc(-c3nc(C(F)(F)F)c(C(=O)O)o3)cc12.
What is the InChIKey of 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid?
The InChIKey is HCJDLOXAJYANJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F3N4O4/c1-7-12(8(2)28-23-7)10-6-21-24-4-3-9(5-11(10)24)15-22-14(17(18,19)20)13(27-15)16(25)26/h3-6H,1-2H3,(H,25,26).
What are the key properties of 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid?
2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid has a molecular weight of 392.29 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid is sourced from PubChem (CID 154690739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).