2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole

C26H22N2O2 — CID 18879179

IUPAC2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole
SMILESCOc1ccc(-c2nc3ccccc3n2CCOc2ccc3ccccc3c2)cc1
InChIInChI=1S/C26H22N2O2/c1-29-22-13-11-20(12-14-22)26-27-24-8-4-5-9-25(24)28(26)16-17-30-23-15-10-19-6-2-3-7-21(19)18-23/h2-15,18H,16-17H2,1H3
InChIKeyAPGKHSOPEQKAGQ-UHFFFAOYSA-N
MW394.47 g/mol
LogP5.94
Rot. Bonds6

About 2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole

2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole (PubChem CID 18879179) has the molecular formula C26H22N2O2 and a molecular weight of 394.47 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole
PubChem CID18879179
Molecular FormulaC26H22N2O2
Molecular Weight394.47 g/mol
Exact Mass394.17
IUPAC Name2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole
SMILESCOc1ccc(-c2nc3ccccc3n2CCOc2ccc3ccccc3c2)cc1
InChIInChI=1S/C26H22N2O2/c1-29-22-13-11-20(12-14-22)26-27-24-8-4-5-9-25(24)28(26)16-17-30-23-15-10-19-6-2-3-7-21(19)18-23/h2-15,18H,16-17H2,1H3
InChIKeyAPGKHSOPEQKAGQ-UHFFFAOYSA-N
XLogP5.94
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.47
LogP ≤ 55.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxyphenyl)-1-(3-naphthalen-2-yloxypropyl)benzimidazole
CID 18879176
2-(4-methoxyphenyl)-1-[2-(3-methylphenoxy)ethyl]benzimidazole
CID 17001320
1-[2-(4-methoxyphenoxy)ethyl]-2-phenylbenzimidazole
CID 17000523
2-(3-methoxyphenyl)-1-(3-naphthalen-2-yloxypropyl)benzimidazole
CID 17001765
1-[3-(3,5-dimethylphenoxy)propyl]-2-(4-methoxyphenyl)benzimidazole
CID 17001345
2-(3-bromophenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole
CID 18879114
1-(2-ethoxyethyl)-2-(4-methoxyphenyl)benzimidazole
CID 3507993
2-(4-bromophenyl)-1-[3-(4-methoxyphenoxy)propyl]benzimidazole
CID 17001216
2-(2,4-dimethylphenyl)-1-[2-(4-methoxyphenoxy)ethyl]benzimidazole
CID 16987578
2-(3,4-dimethoxyphenyl)-1-[2-(4-propan-2-ylphenoxy)ethyl]benzimidazole
CID 17001430
2-(3,4-dimethoxyphenyl)-1-[3-(4-methoxyphenoxy)propyl]benzimidazole
CID 17001455
1-[3-(2,6-dimethylphenoxy)propyl]-2-(4-methoxyphenyl)benzimidazole
CID 17001335

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole?
The IUPAC name of 2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole (CID 18879179) is 2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole.
What is the SMILES notation for 2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole?
The canonical SMILES for 2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole is COc1ccc(-c2nc3ccccc3n2CCOc2ccc3ccccc3c2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole?
The InChIKey is APGKHSOPEQKAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O2/c1-29-22-13-11-20(12-14-22)26-27-24-8-4-5-9-25(24)28(26)16-17-30-23-15-10-19-6-2-3-7-21(19)18-23/h2-15,18H,16-17H2,1H3.
What are the key properties of 2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole?
2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole has a molecular weight of 394.47 g/mol, XLogP of 5.94, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-1-(2-naphthalen-2-yloxyethyl)benzimidazole is sourced from PubChem (CID 18879179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).