3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione

C36H62N4O4 — CID 18715875

IUPAC3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESCCC(C)CC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C(CC)CC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C
InChIInChI=1S/C36H62N4O4/c1-13-21(3)15-27-28(32(44)40(31(27)43)25-19-35(9,10)38-36(11,12)20-25)23(14-2)16-26-22(4)29(41)39(30(26)42)24-17-33(5,6)37-34(7,8)18-24/h21-28,37-38H,13-20H2,1-12H3
InChIKeyVCXRZKWFWNDNKV-UHFFFAOYSA-N
MW614.92 g/mol
LogP5.68
Rot. Bonds9

About 3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione

3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione (PubChem CID 18715875) has the molecular formula C36H62N4O4 and a molecular weight of 614.92 g/mol. Its IUPAC name is 3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
PubChem CID18715875
Molecular FormulaC36H62N4O4
Molecular Weight614.92 g/mol
Exact Mass614.48
IUPAC Name3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESCCC(C)CC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C(CC)CC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C
InChIInChI=1S/C36H62N4O4/c1-13-21(3)15-27-28(32(44)40(31(27)43)25-19-35(9,10)38-36(11,12)20-25)23(14-2)16-26-22(4)29(41)39(30(26)42)24-17-33(5,6)37-34(7,8)18-24/h21-28,37-38H,13-20H2,1-12H3
InChIKeyVCXRZKWFWNDNKV-UHFFFAOYSA-N
XLogP5.68
TPSA98.82 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500614.92
LogP ≤ 55.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The IUPAC name of 3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione (CID 18715875) is 3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The canonical SMILES for 3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione is CCC(C)CC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C(CC)CC1C(=O)N(C2CC(C)(C)NC(C)(C)C2)C(=O)C1C.
What is the InChIKey of 3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The InChIKey is VCXRZKWFWNDNKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H62N4O4/c1-13-21(3)15-27-28(32(44)40(31(27)43)25-19-35(9,10)38-36(11,12)20-25)23(14-2)16-26-22(4)29(41)39(30(26)42)24-17-33(5,6)37-34(7,8)18-24/h21-28,37-38H,13-20H2,1-12H3.
What are the key properties of 3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione has a molecular weight of 614.92 g/mol, XLogP of 5.68, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione is sourced from PubChem (CID 18715875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).