3-ethyl-5-methylimidazol-4-amine

C6H11N3 — CID 62075163

IUPAC3-ethyl-5-methylimidazol-4-amine
SMILESCCn1cnc(C)c1N
InChIInChI=1S/C6H11N3/c1-3-9-4-8-5(2)6(9)7/h4H,3,7H2,1-2H3
InChIKeyFQJNGVRHRZRLKA-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.79
Rot. Bonds1

About 3-ethyl-5-methylimidazol-4-amine

3-ethyl-5-methylimidazol-4-amine (PubChem CID 62075163) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 3-ethyl-5-methylimidazol-4-amine.

Molecular Properties

Compound Name3-ethyl-5-methylimidazol-4-amine
PubChem CID62075163
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name3-ethyl-5-methylimidazol-4-amine
SMILESCCn1cnc(C)c1N
InChIInChI=1S/C6H11N3/c1-3-9-4-8-5(2)6(9)7/h4H,3,7H2,1-2H3
InChIKeyFQJNGVRHRZRLKA-UHFFFAOYSA-N
XLogP0.79
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-ethyl-5-methylimidazol-4-amine 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 3-ethyl-5-methylimidazol-4-amine?
The IUPAC name of 3-ethyl-5-methylimidazol-4-amine (CID 62075163) is 3-ethyl-5-methylimidazol-4-amine.
What is the SMILES notation for 3-ethyl-5-methylimidazol-4-amine?
The canonical SMILES for 3-ethyl-5-methylimidazol-4-amine is CCn1cnc(C)c1N.
What is the InChIKey of 3-ethyl-5-methylimidazol-4-amine?
The InChIKey is FQJNGVRHRZRLKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-3-9-4-8-5(2)6(9)7/h4H,3,7H2,1-2H3.
What are the key properties of 3-ethyl-5-methylimidazol-4-amine?
3-ethyl-5-methylimidazol-4-amine has a molecular weight of 125.17 g/mol, XLogP of 0.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-methylimidazol-4-amine is sourced from PubChem (CID 62075163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).