2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide

C23H25N3O4 — CID 55588683

About 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide

2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide (PubChem CID 55588683) has the molecular formula C23H25N3O4 and a molecular weight of 407.47 g/mol. Its IUPAC name is 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide.

Molecular Properties

• Compound Name: 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide
• PubChem CID: 55588683
• Molecular Formula: C23H25N3O4
• Molecular Weight: 407.47 g/mol
• Exact Mass: 407.18
• IUPAC Name: 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide
• SMILES: CC(C)Oc1ccc(CNC(=O)CN2C(=O)NC3(CCc4ccccc43)C2=O)cc1
• InChI: InChI=1S/C23H25N3O4/c1-15(2)30-18-9-7-16(8-10-18)13-24-20(27)14-26-21(28)23(25-22(26)29)12-11-17-5-3-4-6-19(17)23/h3-10,15H,11-14H2,1-2H3,(H,24,27)(H,25,29)
• InChIKey: QJXLULGLOBEGSJ-UHFFFAOYSA-N
• XLogP: 2.48
• TPSA: 87.74 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	407.47
LogP ≤ 5	2.48
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-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide?

The IUPAC name of 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide (CID 55588683) is 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide.

What is the SMILES notation for 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide?

The canonical SMILES for 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide is CC(C)Oc1ccc(CNC(=O)CN2C(=O)NC3(CCc4ccccc43)C2=O)cc1.

What is the InChIKey of 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide?

The InChIKey is QJXLULGLOBEGSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O4/c1-15(2)30-18-9-7-16(8-10-18)13-24-20(27)14-26-21(28)23(25-22(26)29)12-11-17-5-3-4-6-19(17)23/h3-10,15H,11-14H2,1-2H3,(H,24,27)(H,25,29).

What are the key properties of 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide?

2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide has a molecular weight of 407.47 g/mol, XLogP of 2.48, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide is sourced from PubChem (CID 55588683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).