5-methoxy-1,2,4-trimethylimidazole

C7H12N2O — CID 58059400

IUPAC5-methoxy-1,2,4-trimethylimidazole
SMILESCOc1c(C)nc(C)n1C
InChIInChI=1S/C7H12N2O/c1-5-7(10-4)9(3)6(2)8-5/h1-4H3
InChIKeyYOVYWSONYBVWQX-UHFFFAOYSA-N
MW140.19 g/mol
LogP1.05
Rot. Bonds1

About 5-methoxy-1,2,4-trimethylimidazole

5-methoxy-1,2,4-trimethylimidazole (PubChem CID 58059400) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 5-methoxy-1,2,4-trimethylimidazole.

Molecular Properties

Compound Name5-methoxy-1,2,4-trimethylimidazole
PubChem CID58059400
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name5-methoxy-1,2,4-trimethylimidazole
SMILESCOc1c(C)nc(C)n1C
InChIInChI=1S/C7H12N2O/c1-5-7(10-4)9(3)6(2)8-5/h1-4H3
InChIKeyYOVYWSONYBVWQX-UHFFFAOYSA-N
XLogP1.05
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1,2,4-trimethylimidazole?
The IUPAC name of 5-methoxy-1,2,4-trimethylimidazole (CID 58059400) is 5-methoxy-1,2,4-trimethylimidazole.
What is the SMILES notation for 5-methoxy-1,2,4-trimethylimidazole?
The canonical SMILES for 5-methoxy-1,2,4-trimethylimidazole is COc1c(C)nc(C)n1C.
What is the InChIKey of 5-methoxy-1,2,4-trimethylimidazole?
The InChIKey is YOVYWSONYBVWQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-5-7(10-4)9(3)6(2)8-5/h1-4H3.
What are the key properties of 5-methoxy-1,2,4-trimethylimidazole?
5-methoxy-1,2,4-trimethylimidazole has a molecular weight of 140.19 g/mol, XLogP of 1.05, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1,2,4-trimethylimidazole is sourced from PubChem (CID 58059400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).