(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate

C17H31NO7Si — CID 170898911

About (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate

(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate (PubChem CID 170898911) has the molecular formula C17H31NO7Si and a molecular weight of 389.52 g/mol. Its IUPAC name is (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate.

Molecular Properties

• Compound Name: (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate
• PubChem CID: 170898911
• Molecular Formula: C17H31NO7Si
• Molecular Weight: 389.52 g/mol
• Exact Mass: 389.19
• IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate
• SMILES: CC(C)(C)[Si](C)(C)OCCOCCOCCC(=O)ON1C(=O)CCC1=O
• InChI: InChI=1S/C17H31NO7Si/c1-17(2,3)26(4,5)24-13-12-23-11-10-22-9-8-16(21)25-18-14(19)6-7-15(18)20/h6-13H2,1-5H3
• InChIKey: MJVHSZBULJDVTD-UHFFFAOYSA-N
• XLogP: 2.04
• TPSA: 91.37 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 11
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	389.52
LogP ≤ 5	2.04
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate?

The IUPAC name of (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate (CID 170898911) is (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate.

What is the SMILES notation for (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate?

The canonical SMILES for (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate is CC(C)(C)[Si](C)(C)OCCOCCOCCC(=O)ON1C(=O)CCC1=O.

What is the InChIKey of (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate?

The InChIKey is MJVHSZBULJDVTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31NO7Si/c1-17(2,3)26(4,5)24-13-12-23-11-10-22-9-8-16(21)25-18-14(19)6-7-15(18)20/h6-13H2,1-5H3.

What are the key properties of (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate?

(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate has a molecular weight of 389.52 g/mol, XLogP of 2.04, 11 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]propanoate is sourced from PubChem (CID 170898911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).