1,2-dipyridin-2-ylbenzimidazole

C17H12N4 — CID 122179936

IUPAC1,2-dipyridin-2-ylbenzimidazole
SMILESc1ccc(-c2nc3ccccc3n2-c2ccccn2)nc1
InChIInChI=1S/C17H12N4/c1-2-9-15-13(7-1)20-17(14-8-3-5-11-18-14)21(15)16-10-4-6-12-19-16/h1-12H
InChIKeyUBAXBOPLPSYNBZ-UHFFFAOYSA-N
MW272.31 g/mol
LogP3.48
Rot. Bonds2

About 1,2-dipyridin-2-ylbenzimidazole

1,2-dipyridin-2-ylbenzimidazole (PubChem CID 122179936) has the molecular formula C17H12N4 and a molecular weight of 272.31 g/mol. Its IUPAC name is 1,2-dipyridin-2-ylbenzimidazole.

Molecular Properties

Compound Name1,2-dipyridin-2-ylbenzimidazole
PubChem CID122179936
Molecular FormulaC17H12N4
Molecular Weight272.31 g/mol
Exact Mass272.11
IUPAC Name1,2-dipyridin-2-ylbenzimidazole
SMILESc1ccc(-c2nc3ccccc3n2-c2ccccn2)nc1
InChIInChI=1S/C17H12N4/c1-2-9-15-13(7-1)20-17(14-8-3-5-11-18-14)21(15)16-10-4-6-12-19-16/h1-12H
InChIKeyUBAXBOPLPSYNBZ-UHFFFAOYSA-N
XLogP3.48
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,2-dipyridin-2-ylbenzimidazole?
The IUPAC name of 1,2-dipyridin-2-ylbenzimidazole (CID 122179936) is 1,2-dipyridin-2-ylbenzimidazole.
What is the SMILES notation for 1,2-dipyridin-2-ylbenzimidazole?
The canonical SMILES for 1,2-dipyridin-2-ylbenzimidazole is c1ccc(-c2nc3ccccc3n2-c2ccccn2)nc1.
What is the InChIKey of 1,2-dipyridin-2-ylbenzimidazole?
The InChIKey is UBAXBOPLPSYNBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4/c1-2-9-15-13(7-1)20-17(14-8-3-5-11-18-14)21(15)16-10-4-6-12-19-16/h1-12H.
What are the key properties of 1,2-dipyridin-2-ylbenzimidazole?
1,2-dipyridin-2-ylbenzimidazole has a molecular weight of 272.31 g/mol, XLogP of 3.48, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dipyridin-2-ylbenzimidazole is sourced from PubChem (CID 122179936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).