2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole

C17H18N2O — CID 2948275

IUPAC2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole
SMILESCOCc1nc2ccccc2n1CCc1ccccc1
InChIInChI=1S/C17H18N2O/c1-20-13-17-18-15-9-5-6-10-16(15)19(17)12-11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3
InChIKeyNKANPLQXIPRQKX-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.43
Rot. Bonds5

About 2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole

2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole (PubChem CID 2948275) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole.

Molecular Properties

Compound Name2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole
PubChem CID2948275
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole
SMILESCOCc1nc2ccccc2n1CCc1ccccc1
InChIInChI=1S/C17H18N2O/c1-20-13-17-18-15-9-5-6-10-16(15)19(17)12-11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3
InChIKeyNKANPLQXIPRQKX-UHFFFAOYSA-N
XLogP3.43
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole?
The IUPAC name of 2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole (CID 2948275) is 2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole.
What is the SMILES notation for 2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole?
The canonical SMILES for 2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole is COCc1nc2ccccc2n1CCc1ccccc1.
What is the InChIKey of 2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole?
The InChIKey is NKANPLQXIPRQKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-20-13-17-18-15-9-5-6-10-16(15)19(17)12-11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3.
What are the key properties of 2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole?
2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole has a molecular weight of 266.34 g/mol, XLogP of 3.43, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-1-(2-phenylethyl)benzimidazole is sourced from PubChem (CID 2948275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).