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

C15H14N2O2 — CID 752039

IUPAC2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole
SMILESCOc1ccccc1OCc1nc2ccccc2[nH]1
InChIInChI=1S/C15H14N2O2/c1-18-13-8-4-5-9-14(13)19-10-15-16-11-6-2-3-7-12(11)17-15/h2-9H,10H2,1H3,(H,16,17)
InChIKeyMWKOUPJMMYDGLH-UHFFFAOYSA-N
MW254.29 g/mol
LogP3.15
Rot. Bonds4

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

2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole (PubChem CID 752039) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole.

Molecular Properties

Compound Name2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole
PubChem CID752039
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole
SMILESCOc1ccccc1OCc1nc2ccccc2[nH]1
InChIInChI=1S/C15H14N2O2/c1-18-13-8-4-5-9-14(13)19-10-15-16-11-6-2-3-7-12(11)17-15/h2-9H,10H2,1H3,(H,16,17)
InChIKeyMWKOUPJMMYDGLH-UHFFFAOYSA-N
XLogP3.15
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole?
The IUPAC name of 2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole (CID 752039) is 2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole.
What is the SMILES notation for 2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole?
The canonical SMILES for 2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole is COc1ccccc1OCc1nc2ccccc2[nH]1.
What is the InChIKey of 2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole?
The InChIKey is MWKOUPJMMYDGLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-18-13-8-4-5-9-14(13)19-10-15-16-11-6-2-3-7-12(11)17-15/h2-9H,10H2,1H3,(H,16,17).
What are the key properties of 2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole?
2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole has a molecular weight of 254.29 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole is sourced from PubChem (CID 752039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).