4-(methoxymethyl)-2,5-dimethyl-1H-imidazole

C7H12N2O — CID 23462112

IUPAC4-(methoxymethyl)-2,5-dimethyl-1H-imidazole
SMILESCOCc1nc(C)[nH]c1C
InChIInChI=1S/C7H12N2O/c1-5-7(4-10-3)9-6(2)8-5/h4H2,1-3H3,(H,8,9)
InChIKeyGIJUPFHEPFPJCU-UHFFFAOYSA-N
MW140.19 g/mol
LogP1.17
Rot. Bonds2

About 4-(methoxymethyl)-2,5-dimethyl-1H-imidazole

4-(methoxymethyl)-2,5-dimethyl-1H-imidazole (PubChem CID 23462112) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 4-(methoxymethyl)-2,5-dimethyl-1H-imidazole.

Molecular Properties

Compound Name4-(methoxymethyl)-2,5-dimethyl-1H-imidazole
PubChem CID23462112
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name4-(methoxymethyl)-2,5-dimethyl-1H-imidazole
SMILESCOCc1nc(C)[nH]c1C
InChIInChI=1S/C7H12N2O/c1-5-7(4-10-3)9-6(2)8-5/h4H2,1-3H3,(H,8,9)
InChIKeyGIJUPFHEPFPJCU-UHFFFAOYSA-N
XLogP1.17
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-2,5-dimethyl-1H-imidazole?
The IUPAC name of 4-(methoxymethyl)-2,5-dimethyl-1H-imidazole (CID 23462112) is 4-(methoxymethyl)-2,5-dimethyl-1H-imidazole.
What is the SMILES notation for 4-(methoxymethyl)-2,5-dimethyl-1H-imidazole?
The canonical SMILES for 4-(methoxymethyl)-2,5-dimethyl-1H-imidazole is COCc1nc(C)[nH]c1C.
What is the InChIKey of 4-(methoxymethyl)-2,5-dimethyl-1H-imidazole?
The InChIKey is GIJUPFHEPFPJCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-5-7(4-10-3)9-6(2)8-5/h4H2,1-3H3,(H,8,9).
What are the key properties of 4-(methoxymethyl)-2,5-dimethyl-1H-imidazole?
4-(methoxymethyl)-2,5-dimethyl-1H-imidazole has a molecular weight of 140.19 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-2,5-dimethyl-1H-imidazole is sourced from PubChem (CID 23462112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).