2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C25H26N4O4 — CID 55481314

About 2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 55481314) has the molecular formula C25H26N4O4 and a molecular weight of 446.51 g/mol. Its IUPAC name is 2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

• Compound Name: 2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
• PubChem CID: 55481314
• Molecular Formula: C25H26N4O4
• Molecular Weight: 446.51 g/mol
• Exact Mass: 446.20
• IUPAC Name: 2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
• SMILES: CC1(c2ccc3c(c2)CCC3)NC(=O)N(CC(=O)Nc2ccccc2N2CCCC2=O)C1=O
• InChI: InChI=1S/C25H26N4O4/c1-25(18-12-11-16-6-4-7-17(16)14-18)23(32)29(24(33)27-25)15-21(30)26-19-8-2-3-9-20(19)28-13-5-10-22(28)31/h2-3,8-9,11-12,14H,4-7,10,13,15H2,1H3,(H,26,30)(H,27,33)
• InChIKey: DOMXMLYWIDYVKZ-UHFFFAOYSA-N
• XLogP: 2.71
• TPSA: 98.82 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	446.51
LogP ≤ 5	2.71
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-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?

The IUPAC name of 2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 55481314) is 2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

What is the SMILES notation for 2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?

The canonical SMILES for 2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide is CC1(c2ccc3c(c2)CCC3)NC(=O)N(CC(=O)Nc2ccccc2N2CCCC2=O)C1=O.

What is the InChIKey of 2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?

The InChIKey is DOMXMLYWIDYVKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O4/c1-25(18-12-11-16-6-4-7-17(16)14-18)23(32)29(24(33)27-25)15-21(30)26-19-8-2-3-9-20(19)28-13-5-10-22(28)31/h2-3,8-9,11-12,14H,4-7,10,13,15H2,1H3,(H,26,30)(H,27,33).

What are the key properties of 2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?

2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 446.51 g/mol, XLogP of 2.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 55481314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).