5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole

C26H26N2 — CID 151682330

IUPAC5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole
SMILESCCc1ccc(/C=C\c2ccc3c(c2)ncn3-c2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C26H26N2/c1-4-20-5-7-21(8-6-20)9-10-22-11-16-26-25(17-22)27-18-28(26)24-14-12-23(13-15-24)19(2)3/h5-19H,4H2,1-3H3/b10-9-
InChIKeyRAUKSGJYQNGCHQ-KTKRTIGZSA-N
MW366.51 g/mol
LogP6.88
Rot. Bonds5

About 5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole

5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole (PubChem CID 151682330) has the molecular formula C26H26N2 and a molecular weight of 366.51 g/mol. Its IUPAC name is 5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole.

Molecular Properties

Compound Name5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole
PubChem CID151682330
Molecular FormulaC26H26N2
Molecular Weight366.51 g/mol
Exact Mass366.21
IUPAC Name5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole
SMILESCCc1ccc(/C=C\c2ccc3c(c2)ncn3-c2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C26H26N2/c1-4-20-5-7-21(8-6-20)9-10-22-11-16-26-25(17-22)27-18-28(26)24-14-12-23(13-15-24)19(2)3/h5-19H,4H2,1-3H3/b10-9-
InChIKeyRAUKSGJYQNGCHQ-KTKRTIGZSA-N
XLogP6.88
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.51
LogP ≤ 56.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

1-(4-propan-2-ylphenyl)-5-[(Z)-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]ethenyl]benzimidazole
CID 175288205
1-(4-ethylphenyl)-N-[(4-propan-2-ylphenyl)methyl]benzimidazol-5-amine
CID 66793952
1-[4-[2-[1-(4-propan-2-yloxyphenyl)benzimidazol-5-yl]ethenyl]phenyl]ethanol
CID 123252574
ethane;1-(3-ethylphenyl)-5-propan-2-ylbenzimidazole
CID 143307448
1-(4-tert-butylphenyl)-N-[(4-propan-2-ylphenyl)methyl]benzimidazol-5-amine
CID 66794060
1-(4-propan-2-ylphenyl)benzimidazole-5-carboxylate
CID 4525946
1-(4-methoxyphenyl)-N-[(4-propan-2-ylphenyl)methyl]benzimidazol-5-amine;hydrochloride
CID 127020969
N-[1-(4-methoxyphenyl)benzimidazol-5-yl]-N-[(4-propan-2-ylphenyl)methyl]acetamide
CID 24748634
5-[(Z)-2-[4-(2-fluoropropan-2-yl)phenyl]ethenyl]-1-(4-propan-2-yloxyphenyl)benzimidazole;1-(4-propan-2-yloxyphenyl)-5-[(Z)-2-(4-prop-1-en-2-ylphenyl)ethenyl]benzimidazole
CID 162205453
[1-hydroxy-1-[4-[2-[1-(4-propan-2-yloxyphenyl)benzimidazol-5-yl]ethenyl]phenyl]ethyl] formate
CID 123243241
ethane;1-ethyl-4-propan-2-ylbenzene
CID 145053715
3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine
CID 174999076

Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole?
The IUPAC name of 5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole (CID 151682330) is 5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole.
What is the SMILES notation for 5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole?
The canonical SMILES for 5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole is CCc1ccc(/C=C\c2ccc3c(c2)ncn3-c2ccc(C(C)C)cc2)cc1.
What is the InChIKey of 5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole?
The InChIKey is RAUKSGJYQNGCHQ-KTKRTIGZSA-N. The full InChI is InChI=1S/C26H26N2/c1-4-20-5-7-21(8-6-20)9-10-22-11-16-26-25(17-22)27-18-28(26)24-14-12-23(13-15-24)19(2)3/h5-19H,4H2,1-3H3/b10-9-.
What are the key properties of 5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole?
5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole has a molecular weight of 366.51 g/mol, XLogP of 6.88, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole is sourced from PubChem (CID 151682330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).