1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione

C16H28N2O2 — CID 21361280

IUPAC1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESCCC1(C)CC(N2C(=O)CCC2=O)C(C)C(C)(CC)N1
InChIInChI=1S/C16H28N2O2/c1-6-15(4)10-12(11(3)16(5,7-2)17-15)18-13(19)8-9-14(18)20/h11-12,17H,6-10H2,1-5H3
InChIKeyRHFGTBIWQDBXJK-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.47
Rot. Bonds3

About 1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione

1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione (PubChem CID 21361280) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is 1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione
PubChem CID21361280
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESCCC1(C)CC(N2C(=O)CCC2=O)C(C)C(C)(CC)N1
InChIInChI=1S/C16H28N2O2/c1-6-15(4)10-12(11(3)16(5,7-2)17-15)18-13(19)8-9-14(18)20/h11-12,17H,6-10H2,1-5H3
InChIKeyRHFGTBIWQDBXJK-UHFFFAOYSA-N
XLogP2.47
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 52.47
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-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The IUPAC name of 1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione (CID 21361280) is 1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The canonical SMILES for 1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione is CCC1(C)CC(N2C(=O)CCC2=O)C(C)C(C)(CC)N1.
What is the InChIKey of 1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The InChIKey is RHFGTBIWQDBXJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-6-15(4)10-12(11(3)16(5,7-2)17-15)18-13(19)8-9-14(18)20/h11-12,17H,6-10H2,1-5H3.
What are the key properties of 1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione?
1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione has a molecular weight of 280.41 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)pyrrolidine-2,5-dione is sourced from PubChem (CID 21361280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).