5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine

C15H19N3 — CID 62225256

IUPAC5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
SMILESC=CCn1c(C)nc(-c2cc(C)cc(C)c2)c1N
InChIInChI=1S/C15H19N3/c1-5-6-18-12(4)17-14(15(18)16)13-8-10(2)7-11(3)9-13/h5,7-9H,1,6,16H2,2-4H3
InChIKeyISEWHTPVGYRROZ-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.24
Rot. Bonds3

About 5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine

5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine (PubChem CID 62225256) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine.

Molecular Properties

Compound Name5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
PubChem CID62225256
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
SMILESC=CCn1c(C)nc(-c2cc(C)cc(C)c2)c1N
InChIInChI=1S/C15H19N3/c1-5-6-18-12(4)17-14(15(18)16)13-8-10(2)7-11(3)9-13/h5,7-9H,1,6,16H2,2-4H3
InChIKeyISEWHTPVGYRROZ-UHFFFAOYSA-N
XLogP3.24
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-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 5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine?
The IUPAC name of 5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine (CID 62225256) is 5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine.
What is the SMILES notation for 5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine?
The canonical SMILES for 5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine is C=CCn1c(C)nc(-c2cc(C)cc(C)c2)c1N.
What is the InChIKey of 5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine?
The InChIKey is ISEWHTPVGYRROZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-5-6-18-12(4)17-14(15(18)16)13-8-10(2)7-11(3)9-13/h5,7-9H,1,6,16H2,2-4H3.
What are the key properties of 5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine?
5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine has a molecular weight of 241.34 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine is sourced from PubChem (CID 62225256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).