1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole

C17H16N2 — CID 54355497

IUPAC1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole
SMILESCc1ccc(C=Cc2nc3ccccc3n2C)cc1
InChIInChI=1S/C17H16N2/c1-13-7-9-14(10-8-13)11-12-17-18-15-5-3-4-6-16(15)19(17)2/h3-12H,1-2H3
InChIKeyUIVDEWPWOBYQCM-UHFFFAOYSA-N
MW248.33 g/mol
LogP4.05
Rot. Bonds2

About 1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole

1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole (PubChem CID 54355497) has the molecular formula C17H16N2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole.

Molecular Properties

Compound Name1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole
PubChem CID54355497
Molecular FormulaC17H16N2
Molecular Weight248.33 g/mol
Exact Mass248.13
IUPAC Name1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole
SMILESCc1ccc(C=Cc2nc3ccccc3n2C)cc1
InChIInChI=1S/C17H16N2/c1-13-7-9-14(10-8-13)11-12-17-18-15-5-3-4-6-16(15)19(17)2/h3-12H,1-2H3
InChIKeyUIVDEWPWOBYQCM-UHFFFAOYSA-N
XLogP4.05
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 2930485
2-[(E)-2-(4-methylphenyl)ethenyl]-1-(2-methylpropyl)benzimidazole
CID 157188103
2-[2-[(E)-2-(4-methylphenyl)ethenyl]benzimidazol-1-yl]acetonitrile
CID 82144945
1-methyl-2-(2-thiophen-2-ylethenyl)benzimidazole
CID 5115727
1-methyl-2-[2-[1-methyl-2-[4-[1-methyl-3-[2-(1-methylbenzimidazol-2-yl)ethenyl]indol-2-yl]phenyl]indol-3-yl]ethenyl]benzimidazole
CID 72638880
2-[2-(furan-2-yl)ethenyl]-1-methylbenzimidazole
CID 2871543
3-(1-methylbenzimidazol-2-yl)prop-2-enoic acid
CID 593912
N-[(1-methylbenzimidazol-2-yl)methylidene]hydroxylamine
CID 18173
1-methyl-2-[2-(3-methyl-1,2-dihydrobenzimidazol-2-yl)ethenyl]benzimidazole
CID 59063246
5-chloro-2-[(E)-2-(4-chlorophenyl)ethenyl]-1-methylbenzimidazole
CID 67635147
1-methyl-3-(2-phenylethenyl)quinoxaline-2-thione
CID 86032036
2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole
CID 3787775

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole?
The IUPAC name of 1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole (CID 54355497) is 1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole.
What is the SMILES notation for 1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole?
The canonical SMILES for 1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole is Cc1ccc(C=Cc2nc3ccccc3n2C)cc1.
What is the InChIKey of 1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole?
The InChIKey is UIVDEWPWOBYQCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2/c1-13-7-9-14(10-8-13)11-12-17-18-15-5-3-4-6-16(15)19(17)2/h3-12H,1-2H3.
What are the key properties of 1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole?
1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole has a molecular weight of 248.33 g/mol, XLogP of 4.05, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[2-(4-methylphenyl)ethenyl]benzimidazole is sourced from PubChem (CID 54355497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).