1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole

C20H18N2O2 — CID 718810

IUPAC1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole
SMILESCOCn1c(COc2ccc3ccccc3c2)nc2ccccc21
InChIInChI=1S/C20H18N2O2/c1-23-14-22-19-9-5-4-8-18(19)21-20(22)13-24-17-11-10-15-6-2-3-7-16(15)12-17/h2-12H,13-14H2,1H3
InChIKeySVSLQQZCADNSBG-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.37
Rot. Bonds5

About 1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole

1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole (PubChem CID 718810) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is 1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole.

Molecular Properties

Compound Name1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole
PubChem CID718810
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC Name1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole
SMILESCOCn1c(COc2ccc3ccccc3c2)nc2ccccc21
InChIInChI=1S/C20H18N2O2/c1-23-14-22-19-9-5-4-8-18(19)21-20(22)13-24-17-11-10-15-6-2-3-7-16(15)12-17/h2-12H,13-14H2,1H3
InChIKeySVSLQQZCADNSBG-UHFFFAOYSA-N
XLogP4.37
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole?
The IUPAC name of 1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole (CID 718810) is 1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole.
What is the SMILES notation for 1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole?
The canonical SMILES for 1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole is COCn1c(COc2ccc3ccccc3c2)nc2ccccc21.
What is the InChIKey of 1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole?
The InChIKey is SVSLQQZCADNSBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-23-14-22-19-9-5-4-8-18(19)21-20(22)13-24-17-11-10-15-6-2-3-7-16(15)12-17/h2-12H,13-14H2,1H3.
What are the key properties of 1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole?
1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole has a molecular weight of 318.38 g/mol, XLogP of 4.37, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-2-(naphthalen-2-yloxymethyl)benzimidazole is sourced from PubChem (CID 718810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).