1-(methoxymethyl)-5-methylimidazole

C6H10N2O — CID 146432143

IUPAC1-(methoxymethyl)-5-methylimidazole
SMILESCOCn1cncc1C
InChIInChI=1S/C6H10N2O/c1-6-3-7-4-8(6)5-9-2/h3-4H,5H2,1-2H3
InChIKeyRUYGDVRATZBKOH-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.80
Rot. Bonds2

About 1-(methoxymethyl)-5-methylimidazole

1-(methoxymethyl)-5-methylimidazole (PubChem CID 146432143) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 1-(methoxymethyl)-5-methylimidazole.

Molecular Properties

Compound Name1-(methoxymethyl)-5-methylimidazole
PubChem CID146432143
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name1-(methoxymethyl)-5-methylimidazole
SMILESCOCn1cncc1C
InChIInChI=1S/C6H10N2O/c1-6-3-7-4-8(6)5-9-2/h3-4H,5H2,1-2H3
InChIKeyRUYGDVRATZBKOH-UHFFFAOYSA-N
XLogP0.80
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-5-methylimidazole?
The IUPAC name of 1-(methoxymethyl)-5-methylimidazole (CID 146432143) is 1-(methoxymethyl)-5-methylimidazole.
What is the SMILES notation for 1-(methoxymethyl)-5-methylimidazole?
The canonical SMILES for 1-(methoxymethyl)-5-methylimidazole is COCn1cncc1C.
What is the InChIKey of 1-(methoxymethyl)-5-methylimidazole?
The InChIKey is RUYGDVRATZBKOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-6-3-7-4-8(6)5-9-2/h3-4H,5H2,1-2H3.
What are the key properties of 1-(methoxymethyl)-5-methylimidazole?
1-(methoxymethyl)-5-methylimidazole has a molecular weight of 126.16 g/mol, XLogP of 0.80, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-5-methylimidazole is sourced from PubChem (CID 146432143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).