1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione

C13H20N2O2 — CID 3019932

IUPAC1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione
SMILESCC1(C)CC(N2C(=O)C=CC2=O)CC(C)(C)N1
InChIInChI=1S/C13H20N2O2/c1-12(2)7-9(8-13(3,4)14-12)15-10(16)5-6-11(15)17/h5-6,9,14H,7-8H2,1-4H3
InChIKeyFFIJIFGRYNWQNQ-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.22
Rot. Bonds1

About 1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione

1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione (PubChem CID 3019932) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione.

Molecular Properties

Compound Name1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione
PubChem CID3019932
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione
SMILESCC1(C)CC(N2C(=O)C=CC2=O)CC(C)(C)N1
InChIInChI=1S/C13H20N2O2/c1-12(2)7-9(8-13(3,4)14-12)15-10(16)5-6-11(15)17/h5-6,9,14H,7-8H2,1-4H3
InChIKeyFFIJIFGRYNWQNQ-UHFFFAOYSA-N
XLogP1.22
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione?
The IUPAC name of 1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione (CID 3019932) is 1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione.
What is the SMILES notation for 1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione?
The canonical SMILES for 1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione is CC1(C)CC(N2C(=O)C=CC2=O)CC(C)(C)N1.
What is the InChIKey of 1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione?
The InChIKey is FFIJIFGRYNWQNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-12(2)7-9(8-13(3,4)14-12)15-10(16)5-6-11(15)17/h5-6,9,14H,7-8H2,1-4H3.
What are the key properties of 1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione?
1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione has a molecular weight of 236.31 g/mol, XLogP of 1.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione is sourced from PubChem (CID 3019932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).