6-chloro-2-(2-phenylethenyl)-1H-benzimidazole

C15H11ClN2 — CID 73193180

IUPAC6-chloro-2-(2-phenylethenyl)-1H-benzimidazole
SMILESClc1ccc2nc(C=Cc3ccccc3)[nH]c2c1
InChIInChI=1S/C15H11ClN2/c16-12-7-8-13-14(10-12)18-15(17-13)9-6-11-4-2-1-3-5-11/h1-10H,(H,17,18)
InChIKeyCGUGNORVEBALDT-UHFFFAOYSA-N
MW254.72 g/mol
LogP4.39
Rot. Bonds2

About 6-chloro-2-(2-phenylethenyl)-1H-benzimidazole

6-chloro-2-(2-phenylethenyl)-1H-benzimidazole (PubChem CID 73193180) has the molecular formula C15H11ClN2 and a molecular weight of 254.72 g/mol. Its IUPAC name is 6-chloro-2-(2-phenylethenyl)-1H-benzimidazole.

Molecular Properties

Compound Name6-chloro-2-(2-phenylethenyl)-1H-benzimidazole
PubChem CID73193180
Molecular FormulaC15H11ClN2
Molecular Weight254.72 g/mol
Exact Mass254.06
IUPAC Name6-chloro-2-(2-phenylethenyl)-1H-benzimidazole
SMILESClc1ccc2nc(C=Cc3ccccc3)[nH]c2c1
InChIInChI=1S/C15H11ClN2/c16-12-7-8-13-14(10-12)18-15(17-13)9-6-11-4-2-1-3-5-11/h1-10H,(H,17,18)
InChIKeyCGUGNORVEBALDT-UHFFFAOYSA-N
XLogP4.39
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.72
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-(4-chlorophenyl)ethenyl]-6-phenyl-1H-benzimidazole
CID 67164143
6-bromo-2-[(E)-2-phenylethenyl]-1H-benzimidazole;ethane
CID 91356602
6-nitro-2-[(Z)-2-phenylethenyl]-1H-benzimidazole
CID 92970296
6-nonyl-2-(2-phenylethenyl)-1H-benzimidazole
CID 67635508
2-[2-[2-[(E)-2-(4-chlorophenyl)ethenyl]-3H-benzimidazol-5-yl]phenyl]propan-2-ol
CID 24759485
7-chloro-3-[(1Z,3E)-2-hydroxy-4-phenylbuta-1,3-dienyl]-1H-quinoxalin-2-one
CID 135493823
2-[2-(4-tert-butylphenyl)ethenyl]-6-phenyl-1H-benzimidazole
CID 141198504
2-[2-[2-(3-chlorophenyl)ethenyl]-3H-benzimidazol-5-yl]benzenesulfonamide
CID 67165745
2,4-dichloro-1-(2-phenylethenyl)benzene
CID 66779322
2-[(E)-2-(4-methylphenyl)ethenyl]-1H-benzimidazole
CID 6048083
4-[2-(1H-benzimidazol-2-yl)ethenyl]aniline
CID 2749986
4,6-dichloro-2-[(E)-2-phenylethenyl]quinoline
CID 146000729

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(2-phenylethenyl)-1H-benzimidazole?
The IUPAC name of 6-chloro-2-(2-phenylethenyl)-1H-benzimidazole (CID 73193180) is 6-chloro-2-(2-phenylethenyl)-1H-benzimidazole.
What is the SMILES notation for 6-chloro-2-(2-phenylethenyl)-1H-benzimidazole?
The canonical SMILES for 6-chloro-2-(2-phenylethenyl)-1H-benzimidazole is Clc1ccc2nc(C=Cc3ccccc3)[nH]c2c1.
What is the InChIKey of 6-chloro-2-(2-phenylethenyl)-1H-benzimidazole?
The InChIKey is CGUGNORVEBALDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2/c16-12-7-8-13-14(10-12)18-15(17-13)9-6-11-4-2-1-3-5-11/h1-10H,(H,17,18).
What are the key properties of 6-chloro-2-(2-phenylethenyl)-1H-benzimidazole?
6-chloro-2-(2-phenylethenyl)-1H-benzimidazole has a molecular weight of 254.72 g/mol, XLogP of 4.39, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(2-phenylethenyl)-1H-benzimidazole is sourced from PubChem (CID 73193180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).