1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole

C18H20N2O — CID 16996191

IUPAC1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole
SMILESCOCCn1c(Cc2ccccc2C)nc2ccccc21
InChIInChI=1S/C18H20N2O/c1-14-7-3-4-8-15(14)13-18-19-16-9-5-6-10-17(16)20(18)11-12-21-2/h3-10H,11-13H2,1-2H3
InChIKeySNXILACZPSPHLE-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.58
Rot. Bonds5

About 1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole

1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole (PubChem CID 16996191) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole.

Molecular Properties

Compound Name1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole
PubChem CID16996191
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole
SMILESCOCCn1c(Cc2ccccc2C)nc2ccccc21
InChIInChI=1S/C18H20N2O/c1-14-7-3-4-8-15(14)13-18-19-16-9-5-6-10-17(16)20(18)11-12-21-2/h3-10H,11-13H2,1-2H3
InChIKeySNXILACZPSPHLE-UHFFFAOYSA-N
XLogP3.58
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2-methylphenoxy)ethyl]-2-[(2-methylphenyl)methyl]benzimidazole
CID 16996113
1-[2-(2,4-dimethylphenoxy)ethyl]-2-[(2-methylphenyl)methyl]benzimidazole
CID 16996115
1-[3-(3-methoxyphenoxy)propyl]-2-[(2-methylphenyl)methyl]benzimidazole
CID 16996152
2-[(2-methylphenyl)methyl]-1-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]benzimidazole
CID 16996118
4-[1-(2-methoxyethyl)benzimidazol-2-yl]-2-methylbutan-2-amine
CID 62389880
1-(2-methoxyethyl)-2-[(3-methylphenoxy)methyl]benzimidazole
CID 16997947
2-ethyl-1-[2-(3-methoxypropoxy)ethyl]benzimidazole
CID 103184188
4-(2-methoxyethyl)-3-[(2-methylphenyl)methyl]-1H-1,2,4-triazole-5-thione
CID 113300452
1-propyl-2-[(1-propylbenzimidazol-2-yl)methyl]benzimidazole
CID 102471082
N-(3-ethoxypropyl)-2-[2-[(2-methylphenyl)methyl]benzimidazol-1-yl]acetamide
CID 17032388
1-[2-(3,4-dimethylphenoxy)ethyl]-2-[(4-methoxyphenyl)methyl]benzimidazole
CID 16995937
1-[2-(3,4-dimethylphenoxy)ethyl]-2-(methoxymethyl)benzimidazole
CID 16996918

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole?
The IUPAC name of 1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole (CID 16996191) is 1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole.
What is the SMILES notation for 1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole?
The canonical SMILES for 1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole is COCCn1c(Cc2ccccc2C)nc2ccccc21.
What is the InChIKey of 1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole?
The InChIKey is SNXILACZPSPHLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-14-7-3-4-8-15(14)13-18-19-16-9-5-6-10-17(16)20(18)11-12-21-2/h3-10H,11-13H2,1-2H3.
What are the key properties of 1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole?
1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole has a molecular weight of 280.37 g/mol, XLogP of 3.58, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-2-[(2-methylphenyl)methyl]benzimidazole is sourced from PubChem (CID 16996191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).