1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione

C18H24N4O6 — CID 18758823

IUPAC1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione
SMILESCC(N1C(=O)CCC1=O)N(C(C)N1C(=O)CCC1=O)C(C)N1C(=O)CCC1=O
InChIInChI=1S/C18H24N4O6/c1-10(20-13(23)4-5-14(20)24)19(11(2)21-15(25)6-7-16(21)26)12(3)22-17(27)8-9-18(22)28/h10-12H,4-9H2,1-3H3
InChIKeyDYOCVSNPRQDQSR-UHFFFAOYSA-N
MW392.41 g/mol
LogP-0.23
Rot. Bonds6

About 1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione

1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione (PubChem CID 18758823) has the molecular formula C18H24N4O6 and a molecular weight of 392.41 g/mol. Its IUPAC name is 1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione
PubChem CID18758823
Molecular FormulaC18H24N4O6
Molecular Weight392.41 g/mol
Exact Mass392.17
IUPAC Name1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione
SMILESCC(N1C(=O)CCC1=O)N(C(C)N1C(=O)CCC1=O)C(C)N1C(=O)CCC1=O
InChIInChI=1S/C18H24N4O6/c1-10(20-13(23)4-5-14(20)24)19(11(2)21-15(25)6-7-16(21)26)12(3)22-17(27)8-9-18(22)28/h10-12H,4-9H2,1-3H3
InChIKeyDYOCVSNPRQDQSR-UHFFFAOYSA-N
XLogP-0.23
TPSA115.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.41
LogP ≤ 5-0.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione?
The IUPAC name of 1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione (CID 18758823) is 1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione?
The canonical SMILES for 1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione is CC(N1C(=O)CCC1=O)N(C(C)N1C(=O)CCC1=O)C(C)N1C(=O)CCC1=O.
What is the InChIKey of 1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione?
The InChIKey is DYOCVSNPRQDQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O6/c1-10(20-13(23)4-5-14(20)24)19(11(2)21-15(25)6-7-16(21)26)12(3)22-17(27)8-9-18(22)28/h10-12H,4-9H2,1-3H3.
What are the key properties of 1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione?
1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione has a molecular weight of 392.41 g/mol, XLogP of -0.23, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[bis[1-(2,5-dioxopyrrolidin-1-yl)ethyl]amino]ethyl]pyrrolidine-2,5-dione is sourced from PubChem (CID 18758823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).