2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole

C17H18N2O — CID 660757

IUPAC2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole
SMILESCCc1nc2ccccc2n1Cc1ccccc1OC
InChIInChI=1S/C17H18N2O/c1-3-17-18-14-9-5-6-10-15(14)19(17)12-13-8-4-7-11-16(13)20-2/h4-11H,3,12H2,1-2H3
InChIKeyNNTTVNGXVPOWDS-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.66
Rot. Bonds4

About 2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole

2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole (PubChem CID 660757) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole.

Molecular Properties

Compound Name2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole
PubChem CID660757
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole
SMILESCCc1nc2ccccc2n1Cc1ccccc1OC
InChIInChI=1S/C17H18N2O/c1-3-17-18-14-9-5-6-10-15(14)19(17)12-13-8-4-7-11-16(13)20-2/h4-11H,3,12H2,1-2H3
InChIKeyNNTTVNGXVPOWDS-UHFFFAOYSA-N
XLogP3.66
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-ethyl-1-[(2-methoxyphenyl)methyl]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-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole?
The IUPAC name of 2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole (CID 660757) is 2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole.
What is the SMILES notation for 2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole?
The canonical SMILES for 2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole is CCc1nc2ccccc2n1Cc1ccccc1OC.
What is the InChIKey of 2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole?
The InChIKey is NNTTVNGXVPOWDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-3-17-18-14-9-5-6-10-15(14)19(17)12-13-8-4-7-11-16(13)20-2/h4-11H,3,12H2,1-2H3.
What are the key properties of 2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole?
2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole has a molecular weight of 266.34 g/mol, XLogP of 3.66, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-[(2-methoxyphenyl)methyl]benzimidazole is sourced from PubChem (CID 660757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).