(2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate

C32H48N6O10 — CID 134275464

About (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate

(2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate (PubChem CID 134275464) has the molecular formula C32H48N6O10 and a molecular weight of 676.77 g/mol. Its IUPAC name is (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate.

Molecular Properties

• Compound Name: (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate
• PubChem CID: 134275464
• Molecular Formula: C32H48N6O10
• Molecular Weight: 676.77 g/mol
• Exact Mass: 676.34
• IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate
• SMILES: CC1CCCC(CC2CCC(C)N(CC(=O)NCCC(=O)ON3C(=O)CCC3=O)C2C)N1CC(=O)NCCC(=O)ON1C(=O)CCC1=O
• InChI: InChI=1S/C32H48N6O10/c1-20-5-4-6-24(36(20)19-26(40)34-16-14-32(46)48-38-29(43)11-12-30(38)44)17-23-8-7-21(2)35(22(23)3)18-25(39)33-15-13-31(45)47-37-27(41)9-10-28(37)42/h20-24H,4-19H2,1-3H3,(H,33,39)(H,34,40)
• InChIKey: NTEZKFRCCUQKOC-UHFFFAOYSA-N
• XLogP: 0.34
• TPSA: 192.04 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 12
• Rotatable Bonds: 14
• Heavy Atoms: 48
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	676.77
LogP ≤ 5	0.34
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate?

The IUPAC name of (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate (CID 134275464) is (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate.

What is the SMILES notation for (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate?

The canonical SMILES for (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate is CC1CCCC(CC2CCC(C)N(CC(=O)NCCC(=O)ON3C(=O)CCC3=O)C2C)N1CC(=O)NCCC(=O)ON1C(=O)CCC1=O.

What is the InChIKey of (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate?

The InChIKey is NTEZKFRCCUQKOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H48N6O10/c1-20-5-4-6-24(36(20)19-26(40)34-16-14-32(46)48-38-29(43)11-12-30(38)44)17-23-8-7-21(2)35(22(23)3)18-25(39)33-15-13-31(45)47-37-27(41)9-10-28(37)42/h20-24H,4-19H2,1-3H3,(H,33,39)(H,34,40).

What are the key properties of (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate?

(2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate has a molecular weight of 676.77 g/mol, XLogP of 0.34, 14 rotatable bonds, 2 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for (2,5-dioxopyrrolidin-1-yl) 3-[[2-[3-[[1-[2-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]amino]-2-oxoethyl]-6-methylpiperidin-2-yl]methyl]-2,6-dimethylpiperidin-1-yl]acetyl]amino]propanoate is sourced from PubChem (CID 134275464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).