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

C23H26N2O2S — CID 41362497

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

N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide (PubChem CID 41362497) has the molecular formula C23H26N2O2S and a molecular weight of 394.54 g/mol. Its IUPAC name is N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

• Compound Name: N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide
• PubChem CID: 41362497
• Molecular Formula: C23H26N2O2S
• Molecular Weight: 394.54 g/mol
• Exact Mass: 394.17
• IUPAC Name: N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide
• SMILES: CCOc1ccc(-c2nc(NC(=O)Cc3ccc(C(C)C)cc3)sc2C)cc1
• InChI: InChI=1S/C23H26N2O2S/c1-5-27-20-12-10-19(11-13-20)22-16(4)28-23(25-22)24-21(26)14-17-6-8-18(9-7-17)15(2)3/h6-13,15H,5,14H2,1-4H3,(H,24,25,26)
• InChIKey: WCUJHDHAMOISEX-UHFFFAOYSA-N
• XLogP: 5.82
• TPSA: 51.22 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 7
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	394.54
LogP ≤ 5	5.82
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide?

The IUPAC name of N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide (CID 41362497) is N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide.

What is the SMILES notation for N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide?

The canonical SMILES for N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide is CCOc1ccc(-c2nc(NC(=O)Cc3ccc(C(C)C)cc3)sc2C)cc1.

What is the InChIKey of N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide?

The InChIKey is WCUJHDHAMOISEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O2S/c1-5-27-20-12-10-19(11-13-20)22-16(4)28-23(25-22)24-21(26)14-17-6-8-18(9-7-17)15(2)3/h6-13,15H,5,14H2,1-4H3,(H,24,25,26).

What are the key properties of N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide?

N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide has a molecular weight of 394.54 g/mol, XLogP of 5.82, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 41362497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).