3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione

C20H36N2O2 — CID 20609188

IUPAC3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESCCC(C)CCC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C
InChIInChI=1S/C20H36N2O2/c1-8-13(2)9-10-16-14(3)17(23)22(18(16)24)15-11-19(4,5)21-20(6,7)12-15/h13-16,21H,8-12H2,1-7H3
InChIKeyHGLMNQDCZJUNGQ-UHFFFAOYSA-N
MW336.52 g/mol
LogP3.74
Rot. Bonds5

About 3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione

3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione (PubChem CID 20609188) has the molecular formula C20H36N2O2 and a molecular weight of 336.52 g/mol. Its IUPAC name is 3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
PubChem CID20609188
Molecular FormulaC20H36N2O2
Molecular Weight336.52 g/mol
Exact Mass336.28
IUPAC Name3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESCCC(C)CCC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C
InChIInChI=1S/C20H36N2O2/c1-8-13(2)9-10-16-14(3)17(23)22(18(16)24)15-11-19(4,5)21-20(6,7)12-15/h13-16,21H,8-12H2,1-7H3
InChIKeyHGLMNQDCZJUNGQ-UHFFFAOYSA-N
XLogP3.74
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.52
LogP ≤ 53.74
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 3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The IUPAC name of 3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione (CID 20609188) is 3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The canonical SMILES for 3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione is CCC(C)CCC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C.
What is the InChIKey of 3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The InChIKey is HGLMNQDCZJUNGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36N2O2/c1-8-13(2)9-10-16-14(3)17(23)22(18(16)24)15-11-19(4,5)21-20(6,7)12-15/h13-16,21H,8-12H2,1-7H3.
What are the key properties of 3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione has a molecular weight of 336.52 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(3-methylpentyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione is sourced from PubChem (CID 20609188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).