2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide

C23H32N4O4 — CID 7618361

About 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide

2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide (PubChem CID 7618361) has the molecular formula C23H32N4O4 and a molecular weight of 428.53 g/mol. Its IUPAC name is 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide.

Molecular Properties

• Compound Name: 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide
• PubChem CID: 7618361
• Molecular Formula: C23H32N4O4
• Molecular Weight: 428.53 g/mol
• Exact Mass: 428.24
• IUPAC Name: 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide
• SMILES: Cc1ccc(C)c(NC(=O)CN(C)C(=O)CN2C(=O)N[C@](C)(C3CCCCC3)C2=O)c1
• InChI: InChI=1S/C23H32N4O4/c1-15-10-11-16(2)18(12-15)24-19(28)13-26(4)20(29)14-27-21(30)23(3,25-22(27)31)17-8-6-5-7-9-17/h10-12,17H,5-9,13-14H2,1-4H3,(H,24,28)(H,25,31)/t23-/m1/s1
• InChIKey: CZSJQWQAVSENDJ-HSZRJFAPSA-N
• XLogP: 2.59
• TPSA: 98.82 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	428.53
LogP ≤ 5	2.59
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide?

The IUPAC name of 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide (CID 7618361) is 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide.

What is the SMILES notation for 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide?

The canonical SMILES for 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide is Cc1ccc(C)c(NC(=O)CN(C)C(=O)CN2C(=O)N[C@](C)(C3CCCCC3)C2=O)c1.

What is the InChIKey of 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide?

The InChIKey is CZSJQWQAVSENDJ-HSZRJFAPSA-N. The full InChI is InChI=1S/C23H32N4O4/c1-15-10-11-16(2)18(12-15)24-19(28)13-26(4)20(29)14-27-21(30)23(3,25-22(27)31)17-8-6-5-7-9-17/h10-12,17H,5-9,13-14H2,1-4H3,(H,24,28)(H,25,31)/t23-/m1/s1.

What are the key properties of 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide?

2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide has a molecular weight of 428.53 g/mol, XLogP of 2.59, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(4R)-4-cyclohexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylacetamide is sourced from PubChem (CID 7618361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).