1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine

C13H17N3O — CID 106557791

IUPAC1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine
SMILESCNc1nc(C)cn1-c1cc(C)ccc1OC
InChIInChI=1S/C13H17N3O/c1-9-5-6-12(17-4)11(7-9)16-8-10(2)15-13(16)14-3/h5-8H,1-4H3,(H,14,15)
InChIKeyXYTFGOYCDXCMGM-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.54
Rot. Bonds3

About 1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine

1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine (PubChem CID 106557791) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is 1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine.

Molecular Properties

Compound Name1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine
PubChem CID106557791
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine
SMILESCNc1nc(C)cn1-c1cc(C)ccc1OC
InChIInChI=1S/C13H17N3O/c1-9-5-6-12(17-4)11(7-9)16-8-10(2)15-13(16)14-3/h5-8H,1-4H3,(H,14,15)
InChIKeyXYTFGOYCDXCMGM-UHFFFAOYSA-N
XLogP2.54
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

1-(2,5-dimethylphenyl)-N,4-dimethylimidazol-2-amine
CID 106558212
1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole
CID 91609134
1-(5-chloro-2-methoxyphenyl)-N-cyclopentyl-4-methylimidazol-2-amine
CID 106557711
3-(2,4-dimethylimidazol-1-yl)-4-methoxyaniline
CID 82512676
1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine
CID 106560683
1-(2,5-dimethylphenyl)-4-methyl-N-propylimidazol-2-amine
CID 106558223
1-(2-methoxy-5-methylphenyl)-2,5-dimethylpyrrole
CID 39243590
1-[2-(3,4-dimethoxyphenyl)ethyl]-N,4-dimethylimidazol-2-amine
CID 106555784
1-(2-fluoro-5-methylphenyl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106561052
1-[2-chloro-5-(trifluoromethyl)phenyl]-N,4-dimethylimidazol-2-amine
CID 106557943
1-[1-(2-methoxy-5-methylphenyl)-3,5-dimethylpyrazol-4-yl]-N-methylmethanamine
CID 84760375
1-(4-chlorophenyl)-N,4-dimethylimidazol-2-amine
CID 106558479

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine?
The IUPAC name of 1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine (CID 106557791) is 1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine.
What is the SMILES notation for 1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine?
The canonical SMILES for 1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine is CNc1nc(C)cn1-c1cc(C)ccc1OC.
What is the InChIKey of 1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine?
The InChIKey is XYTFGOYCDXCMGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-9-5-6-12(17-4)11(7-9)16-8-10(2)15-13(16)14-3/h5-8H,1-4H3,(H,14,15).
What are the key properties of 1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine?
1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine has a molecular weight of 231.30 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine is sourced from PubChem (CID 106557791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).