2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile

C16H10N6 — CID 82567061

IUPAC2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
SMILESN#Cc1cccn2nc(-c3ccc(-n4ccnc4)cc3)nc12
InChIInChI=1S/C16H10N6/c17-10-13-2-1-8-22-16(13)19-15(20-22)12-3-5-14(6-4-12)21-9-7-18-11-21/h1-9,11H
InChIKeyFELWDEZAPKFIJB-UHFFFAOYSA-N
MW286.30 g/mol
LogP2.45
Rot. Bonds2

About 2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile

2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (PubChem CID 82567061) has the molecular formula C16H10N6 and a molecular weight of 286.30 g/mol. Its IUPAC name is 2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile.

Molecular Properties

Compound Name2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
PubChem CID82567061
Molecular FormulaC16H10N6
Molecular Weight286.30 g/mol
Exact Mass286.10
IUPAC Name2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
SMILESN#Cc1cccn2nc(-c3ccc(-n4ccnc4)cc3)nc12
InChIInChI=1S/C16H10N6/c17-10-13-2-1-8-22-16(13)19-15(20-22)12-3-5-14(6-4-12)21-9-7-18-11-21/h1-9,11H
InChIKeyFELWDEZAPKFIJB-UHFFFAOYSA-N
XLogP2.45
TPSA71.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.30
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-[4-[3,5-bis(4-imidazol-1-ylphenyl)phenyl]phenyl]imidazole
CID 102142171
5-(4-imidazol-1-ylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 4773526
8-chloro-2-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 117137892
4-(5-imidazol-1-yl-2-pyridinyl)benzonitrile
CID 118978613
3,5-bis(4-imidazol-1-ylphenyl)-1,2,4-triazol-4-amine
CID 91579296
8-methoxy-2-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 117137886
3-(4-imidazol-1-ylphenyl)prop-2-enenitrile
CID 76913866
(4-imidazol-1-ylphenyl)arsane
CID 173134933
2-[3-(4-imidazol-1-ylphenyl)phenyl]-1,3,5-triazine
CID 141294128
4-(8-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)aniline
CID 83967082
2-amino-4-(3,4-dihydroxyphenyl)-6-(4-imidazol-1-ylphenyl)pyridine-3-carbonitrile
CID 177295555
8-(4-imidazol-1-ylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 23316952

Frequently Asked Questions

What is the IUPAC name of 2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The IUPAC name of 2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (CID 82567061) is 2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile.
What is the SMILES notation for 2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The canonical SMILES for 2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile is N#Cc1cccn2nc(-c3ccc(-n4ccnc4)cc3)nc12.
What is the InChIKey of 2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The InChIKey is FELWDEZAPKFIJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N6/c17-10-13-2-1-8-22-16(13)19-15(20-22)12-3-5-14(6-4-12)21-9-7-18-11-21/h1-9,11H.
What are the key properties of 2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile has a molecular weight of 286.30 g/mol, XLogP of 2.45, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-imidazol-1-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile is sourced from PubChem (CID 82567061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).