2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide

C29H25N3O4 — CID 46665850

About 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide

2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide (PubChem CID 46665850) has the molecular formula C29H25N3O4 and a molecular weight of 479.54 g/mol. Its IUPAC name is 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide.

Molecular Properties

• Compound Name: 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide
• PubChem CID: 46665850
• Molecular Formula: C29H25N3O4
• Molecular Weight: 479.54 g/mol
• Exact Mass: 479.18
• IUPAC Name: 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide
• SMILES: Cc1ccc(Oc2ccccc2NC(=O)CN2C(=O)NC(C)(c3cccc4ccccc34)C2=O)cc1
• InChI: InChI=1S/C29H25N3O4/c1-19-14-16-21(17-15-19)36-25-13-6-5-12-24(25)30-26(33)18-32-27(34)29(2,31-28(32)35)23-11-7-9-20-8-3-4-10-22(20)23/h3-17H,18H2,1-2H3,(H,30,33)(H,31,35)
• InChIKey: RGGGHFZNSDNTBB-UHFFFAOYSA-N
• XLogP: 5.35
• TPSA: 87.74 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	479.54
LogP ≤ 5	5.35
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-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide?

The IUPAC name of 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide (CID 46665850) is 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide.

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

The canonical SMILES for 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide is Cc1ccc(Oc2ccccc2NC(=O)CN2C(=O)NC(C)(c3cccc4ccccc34)C2=O)cc1.

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

The InChIKey is RGGGHFZNSDNTBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H25N3O4/c1-19-14-16-21(17-15-19)36-25-13-6-5-12-24(25)30-26(33)18-32-27(34)29(2,31-28(32)35)23-11-7-9-20-8-3-4-10-22(20)23/h3-17H,18H2,1-2H3,(H,30,33)(H,31,35).

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

2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide has a molecular weight of 479.54 g/mol, XLogP of 5.35, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide is sourced from PubChem (CID 46665850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).