methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione

C20H38N2O2 — CID 160516047

IUPACmethane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESC.CCC(C)CC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C
InChIInChI=1S/C19H34N2O2.CH4/c1-8-12(2)9-15-13(3)16(22)21(17(15)23)14-10-18(4,5)20-19(6,7)11-14;/h12-15,20H,8-11H2,1-7H3;1H4
InChIKeyQTRAYKULDWFIHA-UHFFFAOYSA-N
MW338.54 g/mol
LogP3.99
Rot. Bonds4

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

methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione (PubChem CID 160516047) has the molecular formula C20H38N2O2 and a molecular weight of 338.54 g/mol. Its IUPAC name is methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Namemethane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
PubChem CID160516047
Molecular FormulaC20H38N2O2
Molecular Weight338.54 g/mol
Exact Mass338.29
IUPAC Namemethane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESC.CCC(C)CC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C
InChIInChI=1S/C19H34N2O2.CH4/c1-8-12(2)9-15-13(3)16(22)21(17(15)23)14-10-18(4,5)20-19(6,7)11-14;/h12-15,20H,8-11H2,1-7H3;1H4
InChIKeyQTRAYKULDWFIHA-UHFFFAOYSA-N
XLogP3.99
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.54
LogP ≤ 53.99
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 methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The IUPAC name of methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione (CID 160516047) is methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione.
What is the SMILES notation for methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The canonical SMILES for methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione is C.CCC(C)CC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C.
What is the InChIKey of methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The InChIKey is QTRAYKULDWFIHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N2O2.CH4/c1-8-12(2)9-15-13(3)16(22)21(17(15)23)14-10-18(4,5)20-19(6,7)11-14;/h12-15,20H,8-11H2,1-7H3;1H4.
What are the key properties of methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione has a molecular weight of 338.54 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione is sourced from PubChem (CID 160516047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).