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

C21H22N4O3 — CID 134017562

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

2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-methyl-N-(2-pyridin-2-ylethyl)acetamide (PubChem CID 134017562) has the molecular formula C21H22N4O3 and a molecular weight of 378.43 g/mol. Its IUPAC name is 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-methyl-N-(2-pyridin-2-ylethyl)acetamide.

Molecular Properties

• Compound Name: 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
• PubChem CID: 134017562
• Molecular Formula: C21H22N4O3
• Molecular Weight: 378.43 g/mol
• Exact Mass: 378.17
• IUPAC Name: 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
• SMILES: CN(CCc1ccccn1)C(=O)CN1C(=O)NC2(CCc3ccccc32)C1=O
• InChI: InChI=1S/C21H22N4O3/c1-24(13-10-16-7-4-5-12-22-16)18(26)14-25-19(27)21(23-20(25)28)11-9-15-6-2-3-8-17(15)21/h2-8,12H,9-11,13-14H2,1H3,(H,23,28)
• InChIKey: UKWBDBMGDZTIIE-UHFFFAOYSA-N
• XLogP: 1.48
• TPSA: 82.61 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	378.43
LogP ≤ 5	1.48
H-Bond Donors ≤ 5	1
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-methyl-N-(2-pyridin-2-ylethyl)acetamide?

The IUPAC name of 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-methyl-N-(2-pyridin-2-ylethyl)acetamide (CID 134017562) is 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-methyl-N-(2-pyridin-2-ylethyl)acetamide.

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

The canonical SMILES for 2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-methyl-N-(2-pyridin-2-ylethyl)acetamide is CN(CCc1ccccn1)C(=O)CN1C(=O)NC2(CCc3ccccc32)C1=O.

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

The InChIKey is UKWBDBMGDZTIIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O3/c1-24(13-10-16-7-4-5-12-22-16)18(26)14-25-19(27)21(23-20(25)28)11-9-15-6-2-3-8-17(15)21/h2-8,12H,9-11,13-14H2,1H3,(H,23,28).

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

2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-methyl-N-(2-pyridin-2-ylethyl)acetamide has a molecular weight of 378.43 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 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-methyl-N-(2-pyridin-2-ylethyl)acetamide is sourced from PubChem (CID 134017562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).