5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine

C26H16N10 — CID 15866318

IUPAC5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine
SMILESc1ccc(-c2cnnc(-c3cccc(-c4cccc(-c5nncc(-c6ccccn6)n5)n4)n3)n2)nc1
InChIInChI=1S/C26H16N10/c1-3-13-27-17(7-1)23-15-29-35-25(33-23)21-11-5-9-19(31-21)20-10-6-12-22(32-20)26-34-24(16-30-36-26)18-8-2-4-14-28-18/h1-16H
InChIKeyKGGNWOYXISVOOH-UHFFFAOYSA-N
MW468.48 g/mol
LogP3.97
Rot. Bonds5

About 5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine

5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine (PubChem CID 15866318) has the molecular formula C26H16N10 and a molecular weight of 468.48 g/mol. Its IUPAC name is 5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine.

Molecular Properties

Compound Name5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine
PubChem CID15866318
Molecular FormulaC26H16N10
Molecular Weight468.48 g/mol
Exact Mass468.16
IUPAC Name5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine
SMILESc1ccc(-c2cnnc(-c3cccc(-c4cccc(-c5nncc(-c6ccccn6)n5)n4)n3)n2)nc1
InChIInChI=1S/C26H16N10/c1-3-13-27-17(7-1)23-15-29-35-25(33-23)21-11-5-9-19(31-21)20-10-6-12-22(32-20)26-34-24(16-30-36-26)18-8-2-4-14-28-18/h1-16H
InChIKeyKGGNWOYXISVOOH-UHFFFAOYSA-N
XLogP3.97
TPSA128.90 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.48
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine with MolForge

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Related Compounds

2,4,6-Tris(2'-pyridyl)-1,3,5-triazine
CID 77258
3-(2-Pyridyl)-5,6-diphenyl-1,2,4-triazine
CID 70588
Tt-301
CID 54576073
3-Phenyl-4-(Pyridin-4-Yl)-6-[4-(Pyrimidin-2-Yl)piperazin-1-Yl]pyridazine
CID 24743826
3,5,6-Tri(pyridin-2-yl)-1,2,4-triazine
CID 473557
2,4-Bis(5,6-diphenyl-1,2,4-triazine-3-yl)pyridine
CID 118779
5,6-Diphenyl-3-pyridin-4-yl-1,2,4-triazine
CID 6409328
N-[4-[(3S)-3-aminopiperidin-1-yl]-3-pyridinyl]-2-pyridin-2-ylimidazo[1,5-b]pyridazin-7-amine
CID 71007339
5,7-Dimethyl-2-(2-pyridin-2-ylimidazo[1,2-a]pyrimidin-7-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 118525809
US10336761, Example 49
CID 126499376
2,4-Dipyridin-2-yl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine
CID 5061793
6-Phenyl-3-(2-pyridinyl)-1,2,4-triazine
CID 6405118

Frequently Asked Questions

What is the IUPAC name of 5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine?
The IUPAC name of 5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine (CID 15866318) is 5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine.
What is the SMILES notation for 5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine?
The canonical SMILES for 5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine is c1ccc(-c2cnnc(-c3cccc(-c4cccc(-c5nncc(-c6ccccn6)n5)n4)n3)n2)nc1.
What is the InChIKey of 5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine?
The InChIKey is KGGNWOYXISVOOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H16N10/c1-3-13-27-17(7-1)23-15-29-35-25(33-23)21-11-5-9-19(31-21)20-10-6-12-22(32-20)26-34-24(16-30-36-26)18-8-2-4-14-28-18/h1-16H.
What are the key properties of 5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine?
5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine has a molecular weight of 468.48 g/mol, XLogP of 3.97, 5 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-2-yl-3-[6-[6-(5-pyridin-2-yl-1,2,4-triazin-3-yl)-2-pyridinyl]-2-pyridinyl]-1,2,4-triazine is sourced from PubChem (CID 15866318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).