1-pyrazolidin-1-ylpyrrolidine-2,5-dione

C7H11N3O2 — CID 175231353

IUPAC1-pyrazolidin-1-ylpyrrolidine-2,5-dione
SMILESO=C1CCC(=O)N1N1CCCN1
InChIInChI=1S/C7H11N3O2/c11-6-2-3-7(12)10(6)9-5-1-4-8-9/h8H,1-5H2
InChIKeyLCZUAZKDOHZGHU-UHFFFAOYSA-N
MW169.18 g/mol
LogP-0.74
Rot. Bonds1

About 1-pyrazolidin-1-ylpyrrolidine-2,5-dione

1-pyrazolidin-1-ylpyrrolidine-2,5-dione (PubChem CID 175231353) has the molecular formula C7H11N3O2 and a molecular weight of 169.18 g/mol. Its IUPAC name is 1-pyrazolidin-1-ylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-pyrazolidin-1-ylpyrrolidine-2,5-dione
PubChem CID175231353
Molecular FormulaC7H11N3O2
Molecular Weight169.18 g/mol
Exact Mass169.09
IUPAC Name1-pyrazolidin-1-ylpyrrolidine-2,5-dione
SMILESO=C1CCC(=O)N1N1CCCN1
InChIInChI=1S/C7H11N3O2/c11-6-2-3-7(12)10(6)9-5-1-4-8-9/h8H,1-5H2
InChIKeyLCZUAZKDOHZGHU-UHFFFAOYSA-N
XLogP-0.74
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 5-0.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-pyrazolidin-1-ylpyrrolidine-2,5-dione?
The IUPAC name of 1-pyrazolidin-1-ylpyrrolidine-2,5-dione (CID 175231353) is 1-pyrazolidin-1-ylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-pyrazolidin-1-ylpyrrolidine-2,5-dione?
The canonical SMILES for 1-pyrazolidin-1-ylpyrrolidine-2,5-dione is O=C1CCC(=O)N1N1CCCN1.
What is the InChIKey of 1-pyrazolidin-1-ylpyrrolidine-2,5-dione?
The InChIKey is LCZUAZKDOHZGHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2/c11-6-2-3-7(12)10(6)9-5-1-4-8-9/h8H,1-5H2.
What are the key properties of 1-pyrazolidin-1-ylpyrrolidine-2,5-dione?
1-pyrazolidin-1-ylpyrrolidine-2,5-dione has a molecular weight of 169.18 g/mol, XLogP of -0.74, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrazolidin-1-ylpyrrolidine-2,5-dione is sourced from PubChem (CID 175231353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).