2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide

C17H20N6O4 — CID 70759969

About 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide

2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide (PubChem CID 70759969) has the molecular formula C17H20N6O4 and a molecular weight of 372.39 g/mol. Its IUPAC name is 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide.

Molecular Properties

• Compound Name: 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide
• PubChem CID: 70759969
• Molecular Formula: C17H20N6O4
• Molecular Weight: 372.39 g/mol
• Exact Mass: 372.15
• IUPAC Name: 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide
• SMILES: CCCN1C(=O)NC(CC(=O)N(C)Cc2nc(-c3cccnc3)no2)C1=O
• InChI: InChI=1S/C17H20N6O4/c1-3-7-23-16(25)12(19-17(23)26)8-14(24)22(2)10-13-20-15(21-27-13)11-5-4-6-18-9-11/h4-6,9,12H,3,7-8,10H2,1-2H3,(H,19,26)
• InChIKey: BBWLKEFNCCNXHZ-UHFFFAOYSA-N
• XLogP: 0.81
• TPSA: 121.53 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 7
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	372.39
LogP ≤ 5	0.81
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide?

The IUPAC name of 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide (CID 70759969) is 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide.

What is the SMILES notation for 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide?

The canonical SMILES for 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide is CCCN1C(=O)NC(CC(=O)N(C)Cc2nc(-c3cccnc3)no2)C1=O.

What is the InChIKey of 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide?

The InChIKey is BBWLKEFNCCNXHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6O4/c1-3-7-23-16(25)12(19-17(23)26)8-14(24)22(2)10-13-20-15(21-27-13)11-5-4-6-18-9-11/h4-6,9,12H,3,7-8,10H2,1-2H3,(H,19,26).

What are the key properties of 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide?

2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide has a molecular weight of 372.39 g/mol, XLogP of 0.81, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2,5-dioxo-1-propylimidazolidin-4-yl)-N-methyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide is sourced from PubChem (CID 70759969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).