4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide

C16H12N6O — CID 167969913

IUPAC4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide
SMILESO=C(Nc1ccc2nncn2c1)c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C16H12N6O/c23-16(19-13-3-6-15-20-18-11-22(15)9-13)12-1-4-14(5-2-12)21-8-7-17-10-21/h1-11H,(H,19,23)
InChIKeyQIAXXNQAHIDTND-UHFFFAOYSA-N
MW304.31 g/mol
LogP2.17
Rot. Bonds3

About 4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide

4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide (PubChem CID 167969913) has the molecular formula C16H12N6O and a molecular weight of 304.31 g/mol. Its IUPAC name is 4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide.

Molecular Properties

Compound Name4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide
PubChem CID167969913
Molecular FormulaC16H12N6O
Molecular Weight304.31 g/mol
Exact Mass304.11
IUPAC Name4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide
SMILESO=C(Nc1ccc2nncn2c1)c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C16H12N6O/c23-16(19-13-3-6-15-20-18-11-22(15)9-13)12-1-4-14(5-2-12)21-8-7-17-10-21/h1-11H,(H,19,23)
InChIKeyQIAXXNQAHIDTND-UHFFFAOYSA-N
XLogP2.17
TPSA77.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,6-dimethylphenyl)-4-imidazol-1-ylbenzamide;hydrochloride
CID 23044294
[1,2,4]triazolo[4,3-a]pyridin-6-ylcarbamic acid
CID 66623612
4-imidazol-1-yl-N-(6-methoxy-3-pyridinyl)benzamide
CID 31532934
N-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-imidazol-1-ylbenzamide
CID 75355784
N-(2-aminophenyl)-4-imidazol-1-ylbenzamide
CID 110484015
N-(4-imidazol-1-ylphenyl)acetamide
CID 16761727
N-(4-imidazol-1-ylphenyl)-1-methyltriazole-4-carboxamide
CID 110471581
4-imidazol-1-yl-N-(2-methyl-1,3-benzothiazol-5-yl)benzamide
CID 110445417
N-(1,3-benzothiazol-2-yl)-4-imidazol-1-ylbenzamide
CID 31533716
4-tert-butyl-N-(6-imidazol-1-ylimidazo[1,2-a]pyridin-2-yl)benzamide;methanesulfonic acid
CID 86638590
4-imidazol-1-yl-N-propylbenzamide
CID 31533072
N-[(E)-hydroxyiminomethyl]-4-imidazol-1-ylbenzamide
CID 135478140

Frequently Asked Questions

What is the IUPAC name of 4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide?
The IUPAC name of 4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide (CID 167969913) is 4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide.
What is the SMILES notation for 4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide?
The canonical SMILES for 4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide is O=C(Nc1ccc2nncn2c1)c1ccc(-n2ccnc2)cc1.
What is the InChIKey of 4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide?
The InChIKey is QIAXXNQAHIDTND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N6O/c23-16(19-13-3-6-15-20-18-11-22(15)9-13)12-1-4-14(5-2-12)21-8-7-17-10-21/h1-11H,(H,19,23).
What are the key properties of 4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide?
4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide has a molecular weight of 304.31 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazol-1-yl-N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)benzamide is sourced from PubChem (CID 167969913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).