6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine

C17H11N5O — CID 155524405

IUPAC6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESc1cc(-c2ccc3nnc(-c4ccc5cn[nH]c5c4)n3c2)co1
InChIInChI=1S/C17H11N5O/c1-2-12-8-18-19-15(12)7-11(1)17-21-20-16-4-3-13(9-22(16)17)14-5-6-23-10-14/h1-10H,(H,18,19)
InChIKeyQBOYRDDEOLOAPM-UHFFFAOYSA-N
MW301.31 g/mol
LogP3.53
Rot. Bonds2

About 6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine

6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 155524405) has the molecular formula C17H11N5O and a molecular weight of 301.31 g/mol. Its IUPAC name is 6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID155524405
Molecular FormulaC17H11N5O
Molecular Weight301.31 g/mol
Exact Mass301.10
IUPAC Name6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESc1cc(-c2ccc3nnc(-c4ccc5cn[nH]c5c4)n3c2)co1
InChIInChI=1S/C17H11N5O/c1-2-12-8-18-19-15(12)7-11(1)17-21-20-16-4-3-13(9-22(16)17)14-5-6-23-10-14/h1-10H,(H,18,19)
InChIKeyQBOYRDDEOLOAPM-UHFFFAOYSA-N
XLogP3.53
TPSA72.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.31
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine (CID 155524405) is 6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine is c1cc(-c2ccc3nnc(-c4ccc5cn[nH]c5c4)n3c2)co1.
What is the InChIKey of 6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is QBOYRDDEOLOAPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N5O/c1-2-12-8-18-19-15(12)7-11(1)17-21-20-16-4-3-13(9-22(16)17)14-5-6-23-10-14/h1-10H,(H,18,19).
What are the key properties of 6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine?
6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 301.31 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-3-yl)-3-(1H-indazol-6-yl)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 155524405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).