2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole

C18H18N2 — CID 3787775

IUPAC2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole
SMILESCC(C)n1c(C=Cc2ccccc2)nc2ccccc21
InChIInChI=1S/C18H18N2/c1-14(2)20-17-11-7-6-10-16(17)19-18(20)13-12-15-8-4-3-5-9-15/h3-14H,1-2H3
InChIKeyBZIWOGOCWWZXGQ-UHFFFAOYSA-N
MW262.36 g/mol
LogP4.79
Rot. Bonds3

About 2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole

2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole (PubChem CID 3787775) has the molecular formula C18H18N2 and a molecular weight of 262.36 g/mol. Its IUPAC name is 2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole.

Molecular Properties

Compound Name2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole
PubChem CID3787775
Molecular FormulaC18H18N2
Molecular Weight262.36 g/mol
Exact Mass262.15
IUPAC Name2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole
SMILESCC(C)n1c(C=Cc2ccccc2)nc2ccccc21
InChIInChI=1S/C18H18N2/c1-14(2)20-17-11-7-6-10-16(17)19-18(20)13-12-15-8-4-3-5-9-15/h3-14H,1-2H3
InChIKeyBZIWOGOCWWZXGQ-UHFFFAOYSA-N
XLogP4.79
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(E)-2-(4-fluorophenyl)ethenyl]-1-propan-2-ylbenzimidazole
CID 5293130
2-[(E)-2-(2-methoxyphenyl)ethenyl]-1-[(1S)-1-phenylethyl]benzimidazole
CID 40517498
2-fluoro-1-propan-2-ylbenzimidazole
CID 141105255
1-propan-2-ylbenzimidazole-2-sulfonate
CID 7853257
(E)-1-phenyl-3-[1-(1-phenylethyl)benzimidazol-2-yl]prop-2-en-1-one
CID 43826344
(R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol
CID 799402
1-butyl-2-(2-phenylethenyl)benzimidazole
CID 2896888
1-pentyl-2-(2-phenylethenyl)benzimidazole
CID 3761593
1-[(4-butan-2-ylphenyl)methyl]-2-[(E)-2-phenylethenyl]benzimidazole
CID 16999559
4-[(E)-2-[1-(difluoromethyl)benzimidazol-2-yl]ethenyl]-2,6-dimethoxyphenol
CID 136912886
2-[[(E)-3-phenylprop-2-enyl]-[(1-propan-2-ylbenzimidazol-2-yl)methyl]amino]ethanol
CID 46999098
1-octadecyl-2-(2-phenylethenyl)benzimidazole
CID 4153645

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole?
The IUPAC name of 2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole (CID 3787775) is 2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole.
What is the SMILES notation for 2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole?
The canonical SMILES for 2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole is CC(C)n1c(C=Cc2ccccc2)nc2ccccc21.
What is the InChIKey of 2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole?
The InChIKey is BZIWOGOCWWZXGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2/c1-14(2)20-17-11-7-6-10-16(17)19-18(20)13-12-15-8-4-3-5-9-15/h3-14H,1-2H3.
What are the key properties of 2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole?
2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole has a molecular weight of 262.36 g/mol, XLogP of 4.79, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole is sourced from PubChem (CID 3787775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).