2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine

C15H13N5 — CID 70761562

IUPAC2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1nc2ccc(-c3ccnc4c3ccn4C)cn2n1
InChIInChI=1S/C15H13N5/c1-10-17-14-4-3-11(9-20(14)18-10)12-5-7-16-15-13(12)6-8-19(15)2/h3-9H,1-2H3
InChIKeyMDESDUBMLIKMJF-UHFFFAOYSA-N
MW263.30 g/mol
LogP2.59
Rot. Bonds1

About 2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine

2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 70761562) has the molecular formula C15H13N5 and a molecular weight of 263.30 g/mol. Its IUPAC name is 2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID70761562
Molecular FormulaC15H13N5
Molecular Weight263.30 g/mol
Exact Mass263.12
IUPAC Name2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1nc2ccc(-c3ccnc4c3ccn4C)cn2n1
InChIInChI=1S/C15H13N5/c1-10-17-14-4-3-11(9-20(14)18-10)12-5-7-16-15-13(12)6-8-19(15)2/h3-9H,1-2H3
InChIKeyMDESDUBMLIKMJF-UHFFFAOYSA-N
XLogP2.59
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine (CID 70761562) is 2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine is Cc1nc2ccc(-c3ccnc4c3ccn4C)cn2n1.
What is the InChIKey of 2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is MDESDUBMLIKMJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5/c1-10-17-14-4-3-11(9-20(14)18-10)12-5-7-16-15-13(12)6-8-19(15)2/h3-9H,1-2H3.
What are the key properties of 2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine?
2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 263.30 g/mol, XLogP of 2.59, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 70761562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).