2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine

C13H16N2OS — CID 116864215

IUPAC2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine
SMILESCOc1c(C)cc(-c2nc(N)cs2)c(C)c1C
InChIInChI=1S/C13H16N2OS/c1-7-5-10(13-15-11(14)6-17-13)8(2)9(3)12(7)16-4/h5-6H,14H2,1-4H3
InChIKeyYEOMYCUVLDJVHI-UHFFFAOYSA-N
MW248.35 g/mol
LogP3.33
Rot. Bonds2

About 2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine

2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine (PubChem CID 116864215) has the molecular formula C13H16N2OS and a molecular weight of 248.35 g/mol. Its IUPAC name is 2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine
PubChem CID116864215
Molecular FormulaC13H16N2OS
Molecular Weight248.35 g/mol
Exact Mass248.10
IUPAC Name2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine
SMILESCOc1c(C)cc(-c2nc(N)cs2)c(C)c1C
InChIInChI=1S/C13H16N2OS/c1-7-5-10(13-15-11(14)6-17-13)8(2)9(3)12(7)16-4/h5-6H,14H2,1-4H3
InChIKeyYEOMYCUVLDJVHI-UHFFFAOYSA-N
XLogP3.33
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-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

Related Compounds

4-chloro-2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazole
CID 116892294
[2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-yl]methanol
CID 116889050
2-(7-methoxy-4,8-dimethylquinolin-2-yl)-1,3-thiazol-4-amine
CID 143844698
2-(bromomethyl)-4-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazole
CID 116970317
4-(4-methoxy-2,3,5-trimethylphenyl)-1,3-oxazol-2-amine
CID 82289646
2-(4-methylthiophen-3-yl)-1,3-thiazol-4-amine
CID 83107283
5-(4-methoxy-2,3,5-trimethylphenyl)thiophene-3-carboxylic acid
CID 98020174
[3-(4-methoxy-2,3,5-trimethylphenyl)-1,2,4-oxadiazol-5-yl]methanamine
CID 82479882
2-(5-bromo-2-methylphenyl)-1,3-thiazol-4-amine
CID 116864241
[2-(4-methoxy-3,5-dimethylphenyl)-1,3-thiazol-4-yl]methanamine
CID 82383295
2-(2-fluoro-3-methylphenyl)-1,3-thiazol-4-amine
CID 107113816
2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine
CID 83108842

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine?
The IUPAC name of 2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine (CID 116864215) is 2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine.
What is the SMILES notation for 2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine?
The canonical SMILES for 2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine is COc1c(C)cc(-c2nc(N)cs2)c(C)c1C.
What is the InChIKey of 2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine?
The InChIKey is YEOMYCUVLDJVHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2OS/c1-7-5-10(13-15-11(14)6-17-13)8(2)9(3)12(7)16-4/h5-6H,14H2,1-4H3.
What are the key properties of 2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine?
2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine has a molecular weight of 248.35 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazol-4-amine is sourced from PubChem (CID 116864215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).