2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole

C23H22N2O2 — CID 5088785

IUPAC2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole
SMILESCOc1ccccc1OCc1nc2ccccc2n1C(C)c1ccccc1
InChIInChI=1S/C23H22N2O2/c1-17(18-10-4-3-5-11-18)25-20-13-7-6-12-19(20)24-23(25)16-27-22-15-9-8-14-21(22)26-2/h3-15,17H,16H2,1-2H3
InChIKeyGTHIIFNKXPELHL-UHFFFAOYSA-N
MW358.44 g/mol
LogP5.23
Rot. Bonds6

About 2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole

2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole (PubChem CID 5088785) has the molecular formula C23H22N2O2 and a molecular weight of 358.44 g/mol. Its IUPAC name is 2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole.

Molecular Properties

Compound Name2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole
PubChem CID5088785
Molecular FormulaC23H22N2O2
Molecular Weight358.44 g/mol
Exact Mass358.17
IUPAC Name2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole
SMILESCOc1ccccc1OCc1nc2ccccc2n1C(C)c1ccccc1
InChIInChI=1S/C23H22N2O2/c1-17(18-10-4-3-5-11-18)25-20-13-7-6-12-19(20)24-23(25)16-27-22-15-9-8-14-21(22)26-2/h3-15,17H,16H2,1-2H3
InChIKeyGTHIIFNKXPELHL-UHFFFAOYSA-N
XLogP5.23
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.44
LogP ≤ 55.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole?
The IUPAC name of 2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole (CID 5088785) is 2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole.
What is the SMILES notation for 2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole?
The canonical SMILES for 2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole is COc1ccccc1OCc1nc2ccccc2n1C(C)c1ccccc1.
What is the InChIKey of 2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole?
The InChIKey is GTHIIFNKXPELHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O2/c1-17(18-10-4-3-5-11-18)25-20-13-7-6-12-19(20)24-23(25)16-27-22-15-9-8-14-21(22)26-2/h3-15,17H,16H2,1-2H3.
What are the key properties of 2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole?
2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole has a molecular weight of 358.44 g/mol, XLogP of 5.23, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenoxy)methyl]-1-(1-phenylethyl)benzimidazole is sourced from PubChem (CID 5088785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).