2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine

C13H16N2O2S — CID 116885804

IUPAC2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine
SMILESCNc1sc(-c2ccc(OC)c(OC)c2)nc1C
InChIInChI=1S/C13H16N2O2S/c1-8-12(14-2)18-13(15-8)9-5-6-10(16-3)11(7-9)17-4/h5-7,14H,1-4H3
InChIKeyCXAYPGYBGBUALY-UHFFFAOYSA-N
MW264.35 g/mol
LogP3.18
Rot. Bonds4

About 2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine

2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine (PubChem CID 116885804) has the molecular formula C13H16N2O2S and a molecular weight of 264.35 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine
PubChem CID116885804
Molecular FormulaC13H16N2O2S
Molecular Weight264.35 g/mol
Exact Mass264.09
IUPAC Name2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine
SMILESCNc1sc(-c2ccc(OC)c(OC)c2)nc1C
InChIInChI=1S/C13H16N2O2S/c1-8-12(14-2)18-13(15-8)9-5-6-10(16-3)11(7-9)17-4/h5-7,14H,1-4H3
InChIKeyCXAYPGYBGBUALY-UHFFFAOYSA-N
XLogP3.18
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-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

[2-(4-methoxy-3-methylphenyl)-4-methyl-1,3-thiazol-5-yl]hydrazine
CID 116887770
2-(3,4-dimethoxyphenyl)-4,6-dimethyl-1,3-benzothiazole
CID 95909841
5-(3,4-dimethoxyphenyl)-N,6-dimethylpyridin-2-amine
CID 123389568
2-(3,4-dimethoxyphenyl)-4-(4-fluorophenyl)-5-methyl-1,3-thiazole
CID 9467644
2-[[2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazole-5-carbonyl]amino]-3-methylbutanoic acid
CID 75269417
2-[2-(4-ethoxy-3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]propan-2-ol
CID 82427189
[2-(3-ethoxy-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]methanethiol
CID 82427206
[2-(4-ethoxy-3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]methanethiol
CID 82427187
N-(2,6-difluorophenyl)-2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 134044579
3-[[2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazole-5-carbonyl]amino]-2,2-dimethylpropanoic acid
CID 119250022
2-(3,4-dimethoxyphenyl)-N'-(2-hydroxybenzoyl)-4-methyl-1,3-thiazole-5-carbohydrazide
CID 27698476
N-(3-acetamido-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 24666779

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine (CID 116885804) is 2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine is CNc1sc(-c2ccc(OC)c(OC)c2)nc1C.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine?
The InChIKey is CXAYPGYBGBUALY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2S/c1-8-12(14-2)18-13(15-8)9-5-6-10(16-3)11(7-9)17-4/h5-7,14H,1-4H3.
What are the key properties of 2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine?
2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine has a molecular weight of 264.35 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-N,4-dimethyl-1,3-thiazol-5-amine is sourced from PubChem (CID 116885804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).