1-phenyl-2-(2H-pyridin-1-yl)benzimidazole

C18H15N3 — CID 141194917

IUPAC1-phenyl-2-(2H-pyridin-1-yl)benzimidazole
SMILESC1=CCN(c2nc3ccccc3n2-c2ccccc2)C=C1
InChIInChI=1S/C18H15N3/c1-3-9-15(10-4-1)21-17-12-6-5-11-16(17)19-18(21)20-13-7-2-8-14-20/h1-13H,14H2
InChIKeyFOPUDUZRFOCBNS-UHFFFAOYSA-N
MW273.34 g/mol
LogP3.92
Rot. Bonds2

About 1-phenyl-2-(2H-pyridin-1-yl)benzimidazole

1-phenyl-2-(2H-pyridin-1-yl)benzimidazole (PubChem CID 141194917) has the molecular formula C18H15N3 and a molecular weight of 273.34 g/mol. Its IUPAC name is 1-phenyl-2-(2H-pyridin-1-yl)benzimidazole.

Molecular Properties

Compound Name1-phenyl-2-(2H-pyridin-1-yl)benzimidazole
PubChem CID141194917
Molecular FormulaC18H15N3
Molecular Weight273.34 g/mol
Exact Mass273.13
IUPAC Name1-phenyl-2-(2H-pyridin-1-yl)benzimidazole
SMILESC1=CCN(c2nc3ccccc3n2-c2ccccc2)C=C1
InChIInChI=1S/C18H15N3/c1-3-9-15(10-4-1)21-17-12-6-5-11-16(17)19-18(21)20-13-7-2-8-14-20/h1-13H,14H2
InChIKeyFOPUDUZRFOCBNS-UHFFFAOYSA-N
XLogP3.92
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(2H-pyridin-1-yl)benzimidazole?
The IUPAC name of 1-phenyl-2-(2H-pyridin-1-yl)benzimidazole (CID 141194917) is 1-phenyl-2-(2H-pyridin-1-yl)benzimidazole.
What is the SMILES notation for 1-phenyl-2-(2H-pyridin-1-yl)benzimidazole?
The canonical SMILES for 1-phenyl-2-(2H-pyridin-1-yl)benzimidazole is C1=CCN(c2nc3ccccc3n2-c2ccccc2)C=C1.
What is the InChIKey of 1-phenyl-2-(2H-pyridin-1-yl)benzimidazole?
The InChIKey is FOPUDUZRFOCBNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3/c1-3-9-15(10-4-1)21-17-12-6-5-11-16(17)19-18(21)20-13-7-2-8-14-20/h1-13H,14H2.
What are the key properties of 1-phenyl-2-(2H-pyridin-1-yl)benzimidazole?
1-phenyl-2-(2H-pyridin-1-yl)benzimidazole has a molecular weight of 273.34 g/mol, XLogP of 3.92, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(2H-pyridin-1-yl)benzimidazole is sourced from PubChem (CID 141194917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).