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

C19H22N4O4S — CID 46674232

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

2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide (PubChem CID 46674232) has the molecular formula C19H22N4O4S and a molecular weight of 402.48 g/mol. Its IUPAC name is 2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

• Compound Name: 2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide
• PubChem CID: 46674232
• Molecular Formula: C19H22N4O4S
• Molecular Weight: 402.48 g/mol
• Exact Mass: 402.14
• IUPAC Name: 2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide
• SMILES: COc1ccc(C2(C)NC(=O)N(CC(=O)Nc3nc(C(C)C)cs3)C2=O)cc1
• InChI: InChI=1S/C19H22N4O4S/c1-11(2)14-10-28-17(20-14)21-15(24)9-23-16(25)19(3,22-18(23)26)12-5-7-13(27-4)8-6-12/h5-8,10-11H,9H2,1-4H3,(H,22,26)(H,20,21,24)
• InChIKey: GZRFRYXVMMYTLJ-UHFFFAOYSA-N
• XLogP: 2.68
• TPSA: 100.63 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	402.48
LogP ≤ 5	2.68
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hydantoin', 'substructure': 'N/A'}

Frequently Asked Questions

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

The IUPAC name of 2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide (CID 46674232) is 2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide.

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

The canonical SMILES for 2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide is COc1ccc(C2(C)NC(=O)N(CC(=O)Nc3nc(C(C)C)cs3)C2=O)cc1.

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

The InChIKey is GZRFRYXVMMYTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O4S/c1-11(2)14-10-28-17(20-14)21-15(24)9-23-16(25)19(3,22-18(23)26)12-5-7-13(27-4)8-6-12/h5-8,10-11H,9H2,1-4H3,(H,22,26)(H,20,21,24).

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

2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide has a molecular weight of 402.48 g/mol, XLogP of 2.68, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 46674232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).