1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione

C32H43N7O10 — CID 126579307

About 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione

1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione (PubChem CID 126579307) has the molecular formula C32H43N7O10 and a molecular weight of 685.74 g/mol. Its IUPAC name is 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione.

Molecular Properties

• Compound Name: 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione
• PubChem CID: 126579307
• Molecular Formula: C32H43N7O10
• Molecular Weight: 685.74 g/mol
• Exact Mass: 685.31
• IUPAC Name: 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione
• SMILES: CCN1C(=O)C(C)C(N(C)C2C(=O)N(CN3C(=O)C(C)C(N(C)C4C(=O)N(CN5C(=O)C(C)C(C)C5=O)C(=O)C4C)C3=O)C(=O)C2C)C1=O
• InChI: InChI=1S/C32H43N7O10/c1-10-35-25(42)15(4)19(29(35)46)33(8)20-16(5)27(44)38(31(20)48)12-39-28(45)18(7)22(32(39)49)34(9)21-17(6)26(43)37(30(21)47)11-36-23(40)13(2)14(3)24(36)41/h13-22H,10-12H2,1-9H3
• InChIKey: OKBJNTSUEGFFLS-UHFFFAOYSA-N
• XLogP: -2.08
• TPSA: 193.38 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 9
• Heavy Atoms: 49
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	685.74
LogP ≤ 5	-2.08
H-Bond Donors ≤ 5	0
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 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione?

The IUPAC name of 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione (CID 126579307) is 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione.

What is the SMILES notation for 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione?

The canonical SMILES for 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione is CCN1C(=O)C(C)C(N(C)C2C(=O)N(CN3C(=O)C(C)C(N(C)C4C(=O)N(CN5C(=O)C(C)C(C)C5=O)C(=O)C4C)C3=O)C(=O)C2C)C1=O.

What is the InChIKey of 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione?

The InChIKey is OKBJNTSUEGFFLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H43N7O10/c1-10-35-25(42)15(4)19(29(35)46)33(8)20-16(5)27(44)38(31(20)48)12-39-28(45)18(7)22(32(39)49)34(9)21-17(6)26(43)37(30(21)47)11-36-23(40)13(2)14(3)24(36)41/h13-22H,10-12H2,1-9H3.

What are the key properties of 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione?

1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione has a molecular weight of 685.74 g/mol, XLogP of -2.08, 9 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[[3-[[1-[[3-[(1-ethyl-4-methyl-2,5-dioxopyrrolidin-3-yl)-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-4-methyl-2,5-dioxopyrrolidin-3-yl]-methylamino]-4-methyl-2,5-dioxopyrrolidin-1-yl]methyl]-3,4-dimethylpyrrolidine-2,5-dione is sourced from PubChem (CID 126579307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).