2-(3-ethenylphenyl)-1-phenylbenzimidazole

C21H16N2 — CID 89265101

IUPAC2-(3-ethenylphenyl)-1-phenylbenzimidazole
SMILESC=Cc1cccc(-c2nc3ccccc3n2-c2ccccc2)c1
InChIInChI=1S/C21H16N2/c1-2-16-9-8-10-17(15-16)21-22-19-13-6-7-14-20(19)23(21)18-11-4-3-5-12-18/h2-15H,1H2
InChIKeyLLNXNUBWTKWWBO-UHFFFAOYSA-N
MW296.37 g/mol
LogP5.34
Rot. Bonds3

About 2-(3-ethenylphenyl)-1-phenylbenzimidazole

2-(3-ethenylphenyl)-1-phenylbenzimidazole (PubChem CID 89265101) has the molecular formula C21H16N2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-(3-ethenylphenyl)-1-phenylbenzimidazole.

Molecular Properties

Compound Name2-(3-ethenylphenyl)-1-phenylbenzimidazole
PubChem CID89265101
Molecular FormulaC21H16N2
Molecular Weight296.37 g/mol
Exact Mass296.13
IUPAC Name2-(3-ethenylphenyl)-1-phenylbenzimidazole
SMILESC=Cc1cccc(-c2nc3ccccc3n2-c2ccccc2)c1
InChIInChI=1S/C21H16N2/c1-2-16-9-8-10-17(15-16)21-22-19-13-6-7-14-20(19)23(21)18-11-4-3-5-12-18/h2-15H,1H2
InChIKeyLLNXNUBWTKWWBO-UHFFFAOYSA-N
XLogP5.34
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.37
LogP ≤ 55.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzimidazole
CID 18629889
N,N-diphenyl-3-(1-phenylbenzimidazol-2-yl)aniline
CID 146339319
1-phenyl-2-(1-phenylbenzimidazol-2-yl)benzimidazole
CID 44622931
2-[2,5-bis(1-phenylbenzimidazol-2-yl)phenyl]-1-phenylbenzimidazole
CID 141061579
1-phenyl-2-[3-[(Z)-[(3Z)-3-(pyridin-2-ylmethylidene)isoindol-1-ylidene]methyl]phenyl]benzimidazole
CID 155601746
2-carbazol-9-yl-9-[3-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 144777561
2-[3-[(E)-but-2-enyl]phenyl]-1-phenylbenzimidazole
CID 173482225
1-phenyl-2-(2-phenylphenyl)benzimidazole
CID 139044287
2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-(3-phenylphenyl)benzimidazole
CID 155173937
1-phenyl-2-[3-[7-[3-(1-phenylbenzimidazol-2-yl)phenyl]-9,10-dihydrophenanthren-2-yl]phenyl]benzimidazole
CID 90075826
1,2-diphenylbenzimidazole;ethane;iridium;propane
CID 142394497
2-[7-[4,5-bis(ethenyl)-1-phenylimidazol-2-yl]-9,10,11,12-tetraphenyltriphenylen-2-yl]-1-phenylbenzimidazole
CID 143778808

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethenylphenyl)-1-phenylbenzimidazole?
The IUPAC name of 2-(3-ethenylphenyl)-1-phenylbenzimidazole (CID 89265101) is 2-(3-ethenylphenyl)-1-phenylbenzimidazole.
What is the SMILES notation for 2-(3-ethenylphenyl)-1-phenylbenzimidazole?
The canonical SMILES for 2-(3-ethenylphenyl)-1-phenylbenzimidazole is C=Cc1cccc(-c2nc3ccccc3n2-c2ccccc2)c1.
What is the InChIKey of 2-(3-ethenylphenyl)-1-phenylbenzimidazole?
The InChIKey is LLNXNUBWTKWWBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2/c1-2-16-9-8-10-17(15-16)21-22-19-13-6-7-14-20(19)23(21)18-11-4-3-5-12-18/h2-15H,1H2.
What are the key properties of 2-(3-ethenylphenyl)-1-phenylbenzimidazole?
2-(3-ethenylphenyl)-1-phenylbenzimidazole has a molecular weight of 296.37 g/mol, XLogP of 5.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethenylphenyl)-1-phenylbenzimidazole is sourced from PubChem (CID 89265101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).