4-ethoxy-5-ethyl-1H-imidazole

C7H12N2O — CID 15879919

IUPAC4-ethoxy-5-ethyl-1H-imidazole
SMILESCCOc1nc[nH]c1CC
InChIInChI=1S/C7H12N2O/c1-3-6-7(10-4-2)9-5-8-6/h5H,3-4H2,1-2H3,(H,8,9)
InChIKeyLFPHXUMTXGNAAC-UHFFFAOYSA-N
MW140.19 g/mol
LogP1.37
Rot. Bonds3

About 4-ethoxy-5-ethyl-1H-imidazole

4-ethoxy-5-ethyl-1H-imidazole (PubChem CID 15879919) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 4-ethoxy-5-ethyl-1H-imidazole.

Molecular Properties

Compound Name4-ethoxy-5-ethyl-1H-imidazole
PubChem CID15879919
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name4-ethoxy-5-ethyl-1H-imidazole
SMILESCCOc1nc[nH]c1CC
InChIInChI=1S/C7H12N2O/c1-3-6-7(10-4-2)9-5-8-6/h5H,3-4H2,1-2H3,(H,8,9)
InChIKeyLFPHXUMTXGNAAC-UHFFFAOYSA-N
XLogP1.37
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethoxy-5-ethyl-1H-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-ethoxy-5-ethyl-1H-imidazole?
The IUPAC name of 4-ethoxy-5-ethyl-1H-imidazole (CID 15879919) is 4-ethoxy-5-ethyl-1H-imidazole.
What is the SMILES notation for 4-ethoxy-5-ethyl-1H-imidazole?
The canonical SMILES for 4-ethoxy-5-ethyl-1H-imidazole is CCOc1nc[nH]c1CC.
What is the InChIKey of 4-ethoxy-5-ethyl-1H-imidazole?
The InChIKey is LFPHXUMTXGNAAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-3-6-7(10-4-2)9-5-8-6/h5H,3-4H2,1-2H3,(H,8,9).
What are the key properties of 4-ethoxy-5-ethyl-1H-imidazole?
4-ethoxy-5-ethyl-1H-imidazole has a molecular weight of 140.19 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-5-ethyl-1H-imidazole is sourced from PubChem (CID 15879919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).