2-(2'-Pyridyl)benzimidazole

C12H9N3 — CID 70821

IUPAC2-pyridin-2-yl-1H-benzimidazole
SMILESC1=CC=C2C(=C1)NC(=N2)C3=CC=CC=N3
InChIInChI=1S/C12H9N3/c1-2-6-10-9(5-1)14-12(15-10)11-7-3-4-8-13-11/h1-8H,(H,14,15)
InChIKeyYNFBMDWHEHETJW-UHFFFAOYSA-N
MW195.22 g/mol
LogP2.40
Rot. Bonds1

About 2-(2'-Pyridyl)benzimidazole

2-(2'-Pyridyl)benzimidazole (PubChem CID 70821) has the molecular formula C12H9N3 and a molecular weight of 195.22 g/mol. Its IUPAC name is 2-pyridin-2-yl-1H-benzimidazole.

Molecular Properties

Compound Name2-(2'-Pyridyl)benzimidazole
PubChem CID70821
Molecular FormulaC12H9N3
Molecular Weight195.22 g/mol
Exact Mass195.08
IUPAC Name2-pyridin-2-yl-1H-benzimidazole
SMILESC1=CC=C2C(=C1)NC(=N2)C3=CC=CC=N3
InChIInChI=1S/C12H9N3/c1-2-6-10-9(5-1)14-12(15-10)11-7-3-4-8-13-11/h1-8H,(H,14,15)
InChIKeyYNFBMDWHEHETJW-UHFFFAOYSA-N
XLogP2.40
TPSA41.60 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity219

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Benzimidazole
CID 5798
2-Amino-1-Methyl-6-Phenylimidazo(4,5-b)Pyridine
CID 1530
2-Aminobenzimidazole
CID 13624
Meiqx
CID 62275
Bendazol
CID 12132
Glu-P 2
CID 49970
Glu-P 1
CID 49971
Mavorixafor
CID 11256587
2-Methylbenzimidazole
CID 11984
2-Phenylbenzimidazole
CID 12855
Benzimidazole, 2-butyl-
CID 22122
2-(Trifluoromethyl)-1H-benzimidazole
CID 67560

Frequently Asked Questions

What is the IUPAC name of 2-(2'-Pyridyl)benzimidazole?
The IUPAC name of 2-(2'-Pyridyl)benzimidazole (CID 70821) is 2-pyridin-2-yl-1H-benzimidazole.
What is the SMILES notation for 2-(2'-Pyridyl)benzimidazole?
The canonical SMILES for 2-(2'-Pyridyl)benzimidazole is C1=CC=C2C(=C1)NC(=N2)C3=CC=CC=N3.
What is the InChIKey of 2-(2'-Pyridyl)benzimidazole?
The InChIKey is YNFBMDWHEHETJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3/c1-2-6-10-9(5-1)14-12(15-10)11-7-3-4-8-13-11/h1-8H,(H,14,15).
What are the key properties of 2-(2'-Pyridyl)benzimidazole?
2-(2'-Pyridyl)benzimidazole has a molecular weight of 195.22 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2'-Pyridyl)benzimidazole is sourced from PubChem (CID 70821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).