2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide

C20H20N2OS — CID 2089262

IUPAC2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cc2sc(C)nc2-c2ccc(C)cc2)cc1
InChIInChI=1S/C20H20N2OS/c1-13-4-8-16(9-5-13)20-18(24-15(3)21-20)12-19(23)22-17-10-6-14(2)7-11-17/h4-11H,12H2,1-3H3,(H,22,23)
InChIKeyAGBNUGMAZLDQCH-UHFFFAOYSA-N
MW336.46 g/mol
LogP4.92
Rot. Bonds4

About 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide

2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide (PubChem CID 2089262) has the molecular formula C20H20N2OS and a molecular weight of 336.46 g/mol. Its IUPAC name is 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide
PubChem CID2089262
Molecular FormulaC20H20N2OS
Molecular Weight336.46 g/mol
Exact Mass336.13
IUPAC Name2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cc2sc(C)nc2-c2ccc(C)cc2)cc1
InChIInChI=1S/C20H20N2OS/c1-13-4-8-16(9-5-13)20-18(24-15(3)21-20)12-19(23)22-17-10-6-14(2)7-11-17/h4-11H,12H2,1-3H3,(H,22,23)
InChIKeyAGBNUGMAZLDQCH-UHFFFAOYSA-N
XLogP4.92
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.46
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide 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 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide (CID 2089262) is 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)Cc2sc(C)nc2-c2ccc(C)cc2)cc1.
What is the InChIKey of 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide?
The InChIKey is AGBNUGMAZLDQCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2OS/c1-13-4-8-16(9-5-13)20-18(24-15(3)21-20)12-19(23)22-17-10-6-14(2)7-11-17/h4-11H,12H2,1-3H3,(H,22,23).
What are the key properties of 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide?
2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide has a molecular weight of 336.46 g/mol, XLogP of 4.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 2089262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).