6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide

C16H11FN6O2S — CID 118103887

IUPAC6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
SMILESCc1csc(NC(=O)c2cc(Oc3cncc(F)c3)cn3ncnc23)n1
InChIInChI=1S/C16H11FN6O2S/c1-9-7-26-16(21-9)22-15(24)13-3-12(6-23-14(13)19-8-20-23)25-11-2-10(17)4-18-5-11/h2-8H,1H3,(H,21,22,24)
InChIKeyZOJLVMCRQLGSNI-UHFFFAOYSA-N
MW370.37 g/mol
LogP3.07
Rot. Bonds4

About 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide

6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide (PubChem CID 118103887) has the molecular formula C16H11FN6O2S and a molecular weight of 370.37 g/mol. Its IUPAC name is 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide.

Molecular Properties

Compound Name6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
PubChem CID118103887
Molecular FormulaC16H11FN6O2S
Molecular Weight370.37 g/mol
Exact Mass370.06
IUPAC Name6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
SMILESCc1csc(NC(=O)c2cc(Oc3cncc(F)c3)cn3ncnc23)n1
InChIInChI=1S/C16H11FN6O2S/c1-9-7-26-16(21-9)22-15(24)13-3-12(6-23-14(13)19-8-20-23)25-11-2-10(17)4-18-5-11/h2-8H,1H3,(H,21,22,24)
InChIKeyZOJLVMCRQLGSNI-UHFFFAOYSA-N
XLogP3.07
TPSA94.30 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.37
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The IUPAC name of 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide (CID 118103887) is 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide.
What is the SMILES notation for 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The canonical SMILES for 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide is Cc1csc(NC(=O)c2cc(Oc3cncc(F)c3)cn3ncnc23)n1.
What is the InChIKey of 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The InChIKey is ZOJLVMCRQLGSNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN6O2S/c1-9-7-26-16(21-9)22-15(24)13-3-12(6-23-14(13)19-8-20-23)25-11-2-10(17)4-18-5-11/h2-8H,1H3,(H,21,22,24).
What are the key properties of 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide has a molecular weight of 370.37 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-fluoro-3-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide is sourced from PubChem (CID 118103887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).