1-butyl-2-(2-phenylethenyl)benzimidazole

C19H20N2 — CID 2896888

IUPAC1-butyl-2-(2-phenylethenyl)benzimidazole
SMILESCCCCn1c(C=Cc2ccccc2)nc2ccccc21
InChIInChI=1S/C19H20N2/c1-2-3-15-21-18-12-8-7-11-17(18)20-19(21)14-13-16-9-5-4-6-10-16/h4-14H,2-3,15H2,1H3
InChIKeyMORLWKKIQMIPGB-UHFFFAOYSA-N
MW276.38 g/mol
LogP5.01
Rot. Bonds5

About 1-butyl-2-(2-phenylethenyl)benzimidazole

1-butyl-2-(2-phenylethenyl)benzimidazole (PubChem CID 2896888) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-butyl-2-(2-phenylethenyl)benzimidazole.

Molecular Properties

Compound Name1-butyl-2-(2-phenylethenyl)benzimidazole
PubChem CID2896888
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC Name1-butyl-2-(2-phenylethenyl)benzimidazole
SMILESCCCCn1c(C=Cc2ccccc2)nc2ccccc21
InChIInChI=1S/C19H20N2/c1-2-3-15-21-18-12-8-7-11-17(18)20-19(21)14-13-16-9-5-4-6-10-16/h4-14H,2-3,15H2,1H3
InChIKeyMORLWKKIQMIPGB-UHFFFAOYSA-N
XLogP5.01
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.38
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-pentyl-2-(2-phenylethenyl)benzimidazole
CID 3761593
1-octadecyl-2-(2-phenylethenyl)benzimidazole
CID 4153645
2-[2-(4-methoxyphenyl)ethenyl]-1-nonylbenzimidazole
CID 5088588
2-[(E)-2-(4-methoxyphenyl)ethenyl]-1-undecylbenzimidazole
CID 6266974
1-[4-(4-methoxyphenoxy)butyl]-2-[(E)-2-phenylethenyl]benzimidazole
CID 16999616
1-[4-(2,6-dimethylphenoxy)butyl]-2-[(E)-2-phenylethenyl]benzimidazole
CID 16999604
N,N-dimethyl-4-[2-(1-propylbenzimidazol-2-yl)ethenyl]aniline
CID 78505875
1-(3-naphthalen-2-yloxypropyl)-2-[(E)-2-phenylethenyl]benzimidazole
CID 18879224
2-[(E)-2-(furan-2-yl)ethenyl]-1-undecylbenzimidazole
CID 16999879
2-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(3-phenoxypropyl)benzimidazole
CID 16999687
1-(3-naphthalen-1-yloxypropyl)-2-[(E)-2-phenylethenyl]benzimidazole
CID 18879223
1-butyl-2-(1-butylbenzimidazol-2-yl)benzimidazole
CID 4014777

Frequently Asked Questions

What is the IUPAC name of 1-butyl-2-(2-phenylethenyl)benzimidazole?
The IUPAC name of 1-butyl-2-(2-phenylethenyl)benzimidazole (CID 2896888) is 1-butyl-2-(2-phenylethenyl)benzimidazole.
What is the SMILES notation for 1-butyl-2-(2-phenylethenyl)benzimidazole?
The canonical SMILES for 1-butyl-2-(2-phenylethenyl)benzimidazole is CCCCn1c(C=Cc2ccccc2)nc2ccccc21.
What is the InChIKey of 1-butyl-2-(2-phenylethenyl)benzimidazole?
The InChIKey is MORLWKKIQMIPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-2-3-15-21-18-12-8-7-11-17(18)20-19(21)14-13-16-9-5-4-6-10-16/h4-14H,2-3,15H2,1H3.
What are the key properties of 1-butyl-2-(2-phenylethenyl)benzimidazole?
1-butyl-2-(2-phenylethenyl)benzimidazole has a molecular weight of 276.38 g/mol, XLogP of 5.01, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2-(2-phenylethenyl)benzimidazole is sourced from PubChem (CID 2896888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).