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

C16H15N7OS — CID 121263170

IUPAC6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
SMILESCCn1nccc1-c1cc(C(=O)Nc2nc(C)cs2)c2nncn2c1
InChIInChI=1S/C16H15N7OS/c1-3-23-13(4-5-18-23)11-6-12(14-21-17-9-22(14)7-11)15(24)20-16-19-10(2)8-25-16/h4-9H,3H2,1-2H3,(H,19,20,24)
InChIKeyDODKYRGUYBNYLX-UHFFFAOYSA-N
MW353.41 g/mol
LogP2.63
Rot. Bonds4

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

6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide (PubChem CID 121263170) has the molecular formula C16H15N7OS and a molecular weight of 353.41 g/mol. Its IUPAC name is 6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide.

Molecular Properties

Compound Name6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
PubChem CID121263170
Molecular FormulaC16H15N7OS
Molecular Weight353.41 g/mol
Exact Mass353.11
IUPAC Name6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
SMILESCCn1nccc1-c1cc(C(=O)Nc2nc(C)cs2)c2nncn2c1
InChIInChI=1S/C16H15N7OS/c1-3-23-13(4-5-18-23)11-6-12(14-21-17-9-22(14)7-11)15(24)20-16-19-10(2)8-25-16/h4-9H,3H2,1-2H3,(H,19,20,24)
InChIKeyDODKYRGUYBNYLX-UHFFFAOYSA-N
XLogP2.63
TPSA90.00 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.41
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

6-(3-methylphenyl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 121263190
6-(5-methyl-1H-pyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 121263177
6-(5-methoxy-2-methylphenyl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 121263227
6-(3,5-dimethylphenyl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 121263028
6-(5-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 121263025
3,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 1246749
2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 107358521
2,4-diamino-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 61089683
5-ethyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-3-carboxamide
CID 25237547
2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 2085562
2-chloro-5-methylsulfanyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 973569
2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 46557524

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide?
The IUPAC name of 6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide (CID 121263170) is 6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide.
What is the SMILES notation for 6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide?
The canonical SMILES for 6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide is CCn1nccc1-c1cc(C(=O)Nc2nc(C)cs2)c2nncn2c1.
What is the InChIKey of 6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide?
The InChIKey is DODKYRGUYBNYLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N7OS/c1-3-23-13(4-5-18-23)11-6-12(14-21-17-9-22(14)7-11)15(24)20-16-19-10(2)8-25-16/h4-9H,3H2,1-2H3,(H,19,20,24).
What are the key properties of 6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide?
6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide has a molecular weight of 353.41 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethylpyrazol-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide is sourced from PubChem (CID 121263170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).