4-ethenyl-1-(methoxymethyl)imidazole

C7H10N2O — CID 45087753

IUPAC4-ethenyl-1-(methoxymethyl)imidazole
SMILESC=Cc1cn(COC)cn1
InChIInChI=1S/C7H10N2O/c1-3-7-4-9(5-8-7)6-10-2/h3-5H,1,6H2,2H3
InChIKeyNGLKAMZVUZKWAA-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.13
Rot. Bonds3

About 4-ethenyl-1-(methoxymethyl)imidazole

4-ethenyl-1-(methoxymethyl)imidazole (PubChem CID 45087753) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 4-ethenyl-1-(methoxymethyl)imidazole.

Molecular Properties

Compound Name4-ethenyl-1-(methoxymethyl)imidazole
PubChem CID45087753
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name4-ethenyl-1-(methoxymethyl)imidazole
SMILESC=Cc1cn(COC)cn1
InChIInChI=1S/C7H10N2O/c1-3-7-4-9(5-8-7)6-10-2/h3-5H,1,6H2,2H3
InChIKeyNGLKAMZVUZKWAA-UHFFFAOYSA-N
XLogP1.13
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-1-(methoxymethyl)imidazole?
The IUPAC name of 4-ethenyl-1-(methoxymethyl)imidazole (CID 45087753) is 4-ethenyl-1-(methoxymethyl)imidazole.
What is the SMILES notation for 4-ethenyl-1-(methoxymethyl)imidazole?
The canonical SMILES for 4-ethenyl-1-(methoxymethyl)imidazole is C=Cc1cn(COC)cn1.
What is the InChIKey of 4-ethenyl-1-(methoxymethyl)imidazole?
The InChIKey is NGLKAMZVUZKWAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-3-7-4-9(5-8-7)6-10-2/h3-5H,1,6H2,2H3.
What are the key properties of 4-ethenyl-1-(methoxymethyl)imidazole?
4-ethenyl-1-(methoxymethyl)imidazole has a molecular weight of 138.17 g/mol, XLogP of 1.13, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-1-(methoxymethyl)imidazole is sourced from PubChem (CID 45087753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).