2-ethyl-2-methylimidazole

C6H10N2 — CID 22245395

IUPAC2-ethyl-2-methylimidazole
SMILESCCC1(C)N=CC=N1
InChIInChI=1S/C6H10N2/c1-3-6(2)7-4-5-8-6/h4-5H,3H2,1-2H3
InChIKeyQFRHTANKIYQYLO-UHFFFAOYSA-N
MW110.16 g/mol
LogP1.27
Rot. Bonds1

About 2-ethyl-2-methylimidazole

2-ethyl-2-methylimidazole (PubChem CID 22245395) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 2-ethyl-2-methylimidazole.

Molecular Properties

Compound Name2-ethyl-2-methylimidazole
PubChem CID22245395
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name2-ethyl-2-methylimidazole
SMILESCCC1(C)N=CC=N1
InChIInChI=1S/C6H10N2/c1-3-6(2)7-4-5-8-6/h4-5H,3H2,1-2H3
InChIKeyQFRHTANKIYQYLO-UHFFFAOYSA-N
XLogP1.27
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-2-methylimidazole 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 2-ethyl-2-methylimidazole?
The IUPAC name of 2-ethyl-2-methylimidazole (CID 22245395) is 2-ethyl-2-methylimidazole.
What is the SMILES notation for 2-ethyl-2-methylimidazole?
The canonical SMILES for 2-ethyl-2-methylimidazole is CCC1(C)N=CC=N1.
What is the InChIKey of 2-ethyl-2-methylimidazole?
The InChIKey is QFRHTANKIYQYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-3-6(2)7-4-5-8-6/h4-5H,3H2,1-2H3.
What are the key properties of 2-ethyl-2-methylimidazole?
2-ethyl-2-methylimidazole has a molecular weight of 110.16 g/mol, XLogP of 1.27, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-methylimidazole is sourced from PubChem (CID 22245395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).