2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide

C18H12Cl5N3O3 — CID 42982801

About 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide

2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide (PubChem CID 42982801) has the molecular formula C18H12Cl5N3O3 and a molecular weight of 495.58 g/mol. Its IUPAC name is 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide.

Molecular Properties

• Compound Name: 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide
• PubChem CID: 42982801
• Molecular Formula: C18H12Cl5N3O3
• Molecular Weight: 495.58 g/mol
• Exact Mass: 492.93
• IUPAC Name: 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide
• SMILES: CC1(c2ccc(Cl)cc2Cl)NC(=O)N(CC(=O)Nc2cc(Cl)c(Cl)cc2Cl)C1=O
• InChI: InChI=1S/C18H12Cl5N3O3/c1-18(9-3-2-8(19)4-10(9)20)16(28)26(17(29)25-18)7-15(27)24-14-6-12(22)11(21)5-13(14)23/h2-6H,7H2,1H3,(H,24,27)(H,25,29)
• InChIKey: OWGIDJNBSBFRHI-UHFFFAOYSA-N
• XLogP: 5.36
• TPSA: 78.51 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 4
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	495.58
LogP ≤ 5	5.36
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide?

The IUPAC name of 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide (CID 42982801) is 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide.

What is the SMILES notation for 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide?

The canonical SMILES for 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide is CC1(c2ccc(Cl)cc2Cl)NC(=O)N(CC(=O)Nc2cc(Cl)c(Cl)cc2Cl)C1=O.

What is the InChIKey of 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide?

The InChIKey is OWGIDJNBSBFRHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12Cl5N3O3/c1-18(9-3-2-8(19)4-10(9)20)16(28)26(17(29)25-18)7-15(27)24-14-6-12(22)11(21)5-13(14)23/h2-6H,7H2,1H3,(H,24,27)(H,25,29).

What are the key properties of 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide?

2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide has a molecular weight of 495.58 g/mol, XLogP of 5.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide is sourced from PubChem (CID 42982801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).