4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole

C7H10Br2N2O — CID 22058662

IUPAC4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole
SMILESCCc1nc(Br)c(Br)n1COC
InChIInChI=1S/C7H10Br2N2O/c1-3-5-10-6(8)7(9)11(5)4-12-2/h3-4H2,1-2H3
InChIKeyUTXVDPBEAHIXKU-UHFFFAOYSA-N
MW297.98 g/mol
LogP2.57
Rot. Bonds3

About 4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole

4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole (PubChem CID 22058662) has the molecular formula C7H10Br2N2O and a molecular weight of 297.98 g/mol. Its IUPAC name is 4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole.

Molecular Properties

Compound Name4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole
PubChem CID22058662
Molecular FormulaC7H10Br2N2O
Molecular Weight297.98 g/mol
Exact Mass295.92
IUPAC Name4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole
SMILESCCc1nc(Br)c(Br)n1COC
InChIInChI=1S/C7H10Br2N2O/c1-3-5-10-6(8)7(9)11(5)4-12-2/h3-4H2,1-2H3
InChIKeyUTXVDPBEAHIXKU-UHFFFAOYSA-N
XLogP2.57
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.98
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole?
The IUPAC name of 4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole (CID 22058662) is 4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole.
What is the SMILES notation for 4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole?
The canonical SMILES for 4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole is CCc1nc(Br)c(Br)n1COC.
What is the InChIKey of 4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole?
The InChIKey is UTXVDPBEAHIXKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10Br2N2O/c1-3-5-10-6(8)7(9)11(5)4-12-2/h3-4H2,1-2H3.
What are the key properties of 4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole?
4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole has a molecular weight of 297.98 g/mol, XLogP of 2.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dibromo-2-ethyl-1-(methoxymethyl)imidazole is sourced from PubChem (CID 22058662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).