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

C19H13N5O2S — CID 121263119

IUPAC6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
SMILESCc1csc(NC(=O)c2cc(-c3ccc4occc4c3)cn3ncnc23)n1
InChIInChI=1S/C19H13N5O2S/c1-11-9-27-19(22-11)23-18(25)15-7-14(8-24-17(15)20-10-21-24)12-2-3-16-13(6-12)4-5-26-16/h2-10H,1H3,(H,22,23,25)
InChIKeyVZRZHJIPNJPSCT-UHFFFAOYSA-N
MW375.41 g/mol
LogP4.16
Rot. Bonds3

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

6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide (PubChem CID 121263119) has the molecular formula C19H13N5O2S and a molecular weight of 375.41 g/mol. Its IUPAC name is 6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide.

Molecular Properties

Compound Name6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
PubChem CID121263119
Molecular FormulaC19H13N5O2S
Molecular Weight375.41 g/mol
Exact Mass375.08
IUPAC Name6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
SMILESCc1csc(NC(=O)c2cc(-c3ccc4occc4c3)cn3ncnc23)n1
InChIInChI=1S/C19H13N5O2S/c1-11-9-27-19(22-11)23-18(25)15-7-14(8-24-17(15)20-10-21-24)12-2-3-16-13(6-12)4-5-26-16/h2-10H,1H3,(H,22,23,25)
InChIKeyVZRZHJIPNJPSCT-UHFFFAOYSA-N
XLogP4.16
TPSA85.32 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.41
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The IUPAC name of 6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide (CID 121263119) is 6-(1-benzofuran-5-yl)-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-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The canonical SMILES for 6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide is Cc1csc(NC(=O)c2cc(-c3ccc4occc4c3)cn3ncnc23)n1.
What is the InChIKey of 6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The InChIKey is VZRZHJIPNJPSCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N5O2S/c1-11-9-27-19(22-11)23-18(25)15-7-14(8-24-17(15)20-10-21-24)12-2-3-16-13(6-12)4-5-26-16/h2-10H,1H3,(H,22,23,25).
What are the key properties of 6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide has a molecular weight of 375.41 g/mol, XLogP of 4.16, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-benzofuran-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide is sourced from PubChem (CID 121263119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).