5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine

C18H14N8 — CID 118525812

IUPAC5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCc1ncc(C)n2nc(-c3ccc4nc(-c5cnccn5)[nH]c4c3)nc12
InChIInChI=1S/C18H14N8/c1-10-8-21-11(2)18-24-16(25-26(10)18)12-3-4-13-14(7-12)23-17(22-13)15-9-19-5-6-20-15/h3-9H,1-2H3,(H,22,23)
InChIKeyAMWUVIMAYBKXSF-UHFFFAOYSA-N
MW342.37 g/mol
LogP2.74
Rot. Bonds2

About 5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine

5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine (PubChem CID 118525812) has the molecular formula C18H14N8 and a molecular weight of 342.37 g/mol. Its IUPAC name is 5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine
PubChem CID118525812
Molecular FormulaC18H14N8
Molecular Weight342.37 g/mol
Exact Mass342.13
IUPAC Name5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCc1ncc(C)n2nc(-c3ccc4nc(-c5cnccn5)[nH]c4c3)nc12
InChIInChI=1S/C18H14N8/c1-10-8-21-11(2)18-24-16(25-26(10)18)12-3-4-13-14(7-12)23-17(22-13)15-9-19-5-6-20-15/h3-9H,1-2H3,(H,22,23)
InChIKeyAMWUVIMAYBKXSF-UHFFFAOYSA-N
XLogP2.74
TPSA97.54 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.37
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine?
The IUPAC name of 5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine (CID 118525812) is 5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine.
What is the SMILES notation for 5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine?
The canonical SMILES for 5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine is Cc1ncc(C)n2nc(-c3ccc4nc(-c5cnccn5)[nH]c4c3)nc12.
What is the InChIKey of 5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine?
The InChIKey is AMWUVIMAYBKXSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N8/c1-10-8-21-11(2)18-24-16(25-26(10)18)12-3-4-13-14(7-12)23-17(22-13)15-9-19-5-6-20-15/h3-9H,1-2H3,(H,22,23).
What are the key properties of 5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine?
5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine has a molecular weight of 342.37 g/mol, XLogP of 2.74, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-dimethyl-2-(2-pyrazin-2-yl-3H-benzimidazol-5-yl)-[1,2,4]triazolo[1,5-a]pyrazine is sourced from PubChem (CID 118525812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).