6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C14H12N6 — CID 82555245

IUPAC6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCc1c(-n2cnc3ccccc32)ccc2nc(N)nn12
InChIInChI=1S/C14H12N6/c1-9-11(6-7-13-17-14(15)18-20(9)13)19-8-16-10-4-2-3-5-12(10)19/h2-8H,1H3,(H2,15,18)
InChIKeySKZPYDBZYOQVTJ-UHFFFAOYSA-N
MW264.29 g/mol
LogP1.96
Rot. Bonds1

About 6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine

6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 82555245) has the molecular formula C14H12N6 and a molecular weight of 264.29 g/mol. Its IUPAC name is 6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID82555245
Molecular FormulaC14H12N6
Molecular Weight264.29 g/mol
Exact Mass264.11
IUPAC Name6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCc1c(-n2cnc3ccccc32)ccc2nc(N)nn12
InChIInChI=1S/C14H12N6/c1-9-11(6-7-13-17-14(15)18-20(9)13)19-8-16-10-4-2-3-5-12(10)19/h2-8H,1H3,(H2,15,18)
InChIKeySKZPYDBZYOQVTJ-UHFFFAOYSA-N
XLogP1.96
TPSA74.03 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 82512834
2-(benzimidazol-1-yl)-3-methylquinoxaline
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6-(benzimidazol-1-yl)-2,5-dimethylpyrimidin-4-amine
CID 80854160
1-(2-ethylphenyl)benzimidazole
CID 22078308
2-[4-(benzimidazol-1-yl)-3-methylphenyl]ethanamine
CID 63815534
4-(benzimidazol-1-yl)pyridin-3-amine
CID 28890030
6-(benzimidazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80853978
1-(2,3-dichlorophenyl)benzimidazole
CID 42636654
1-(2-bromo-4-propan-2-ylphenyl)benzimidazole
CID 174453392
[2-(benzimidazol-1-yl)-5-methylphenyl]methanol
CID 114054526
4-(benzimidazol-1-yl)-6-methoxypyrimidin-2-amine
CID 114053321
5-(benzimidazol-1-yl)-1,3-dimethylpyrazol-4-amine
CID 43554355

Frequently Asked Questions

What is the IUPAC name of 6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 82555245) is 6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine is Cc1c(-n2cnc3ccccc32)ccc2nc(N)nn12.
What is the InChIKey of 6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is SKZPYDBZYOQVTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N6/c1-9-11(6-7-13-17-14(15)18-20(9)13)19-8-16-10-4-2-3-5-12(10)19/h2-8H,1H3,(H2,15,18).
What are the key properties of 6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 264.29 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(benzimidazol-1-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 82555245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).