1-(4-ethoxyphenyl)benzimidazole

C15H14N2O — CID 175001446

IUPAC1-(4-ethoxyphenyl)benzimidazole
SMILESCCOc1ccc(-n2cnc3ccccc32)cc1
InChIInChI=1S/C15H14N2O/c1-2-18-13-9-7-12(8-10-13)17-11-16-14-5-3-4-6-15(14)17/h3-11H,2H2,1H3
InChIKeyLXLATWPWXIVBIU-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.42
Rot. Bonds3

About 1-(4-ethoxyphenyl)benzimidazole

1-(4-ethoxyphenyl)benzimidazole (PubChem CID 175001446) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)benzimidazole.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)benzimidazole
PubChem CID175001446
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name1-(4-ethoxyphenyl)benzimidazole
SMILESCCOc1ccc(-n2cnc3ccccc32)cc1
InChIInChI=1S/C15H14N2O/c1-2-18-13-9-7-12(8-10-13)17-11-16-14-5-3-4-6-15(14)17/h3-11H,2H2,1H3
InChIKeyLXLATWPWXIVBIU-UHFFFAOYSA-N
XLogP3.42
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)benzimidazole?
The IUPAC name of 1-(4-ethoxyphenyl)benzimidazole (CID 175001446) is 1-(4-ethoxyphenyl)benzimidazole.
What is the SMILES notation for 1-(4-ethoxyphenyl)benzimidazole?
The canonical SMILES for 1-(4-ethoxyphenyl)benzimidazole is CCOc1ccc(-n2cnc3ccccc32)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)benzimidazole?
The InChIKey is LXLATWPWXIVBIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-2-18-13-9-7-12(8-10-13)17-11-16-14-5-3-4-6-15(14)17/h3-11H,2H2,1H3.
What are the key properties of 1-(4-ethoxyphenyl)benzimidazole?
1-(4-ethoxyphenyl)benzimidazole has a molecular weight of 238.29 g/mol, XLogP of 3.42, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)benzimidazole is sourced from PubChem (CID 175001446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).