2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione

C12H12N2O4 — CID 156524408

IUPAC2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione
SMILESO=C1CCC(N2C(=O)C3=C(CCC3)C2=O)C(=O)N1
InChIInChI=1S/C12H12N2O4/c15-9-5-4-8(10(16)13-9)14-11(17)6-2-1-3-7(6)12(14)18/h8H,1-5H2,(H,13,15,16)
InChIKeyZXFHNGNJSOEMCG-UHFFFAOYSA-N
MW248.24 g/mol
LogP-0.36
Rot. Bonds1

About 2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione

2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione (PubChem CID 156524408) has the molecular formula C12H12N2O4 and a molecular weight of 248.24 g/mol. Its IUPAC name is 2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione.

Molecular Properties

Compound Name2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione
PubChem CID156524408
Molecular FormulaC12H12N2O4
Molecular Weight248.24 g/mol
Exact Mass248.08
IUPAC Name2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione
SMILESO=C1CCC(N2C(=O)C3=C(CCC3)C2=O)C(=O)N1
InChIInChI=1S/C12H12N2O4/c15-9-5-4-8(10(16)13-9)14-11(17)6-2-1-3-7(6)12(14)18/h8H,1-5H2,(H,13,15,16)
InChIKeyZXFHNGNJSOEMCG-UHFFFAOYSA-N
XLogP-0.36
TPSA83.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.24
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione with MolForge

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Related Compounds

alpha-(3,4,5,6-Tetrahydrophthalimido)-glutarimide
CID 162979
3-(7,10-Difluoro-1-oxo-3,4,5,6,8,9-hexahydro-2-benzazocin-2-yl)piperidine-2,6-dione
CID 175630831
3-(3-Oxo-1,4,5,6-tetrahydrocyclopenta[c]pyrrol-2-yl)piperidine-2,6-dione
CID 168083895
2-[(3S)-2,6-dioxopiperidin-3-yl]-4,5,6,7-tetrahydroisoindole-1,3-dione
CID 12277861
2-(2,5-dioxopyrrolidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione
CID 177863837
2-(3-methyl-2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione
CID 177863839

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione?
The IUPAC name of 2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione (CID 156524408) is 2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione.
What is the SMILES notation for 2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione?
The canonical SMILES for 2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione is O=C1CCC(N2C(=O)C3=C(CCC3)C2=O)C(=O)N1.
What is the InChIKey of 2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione?
The InChIKey is ZXFHNGNJSOEMCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O4/c15-9-5-4-8(10(16)13-9)14-11(17)6-2-1-3-7(6)12(14)18/h8H,1-5H2,(H,13,15,16).
What are the key properties of 2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione?
2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione has a molecular weight of 248.24 g/mol, XLogP of -0.36, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dioxopiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione is sourced from PubChem (CID 156524408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).