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

C39H68N4O4 — CID 20768150

IUPAC3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESCCC(C)CC1C(=O)N(C2CC(C)(C)N(C)C(C)(C)C2)C(=O)C1CC(CC)CC1C(=O)N(C2CC(C)(C)N(C)C(C)(C)C2)C(=O)C1C
InChIInChI=1S/C39H68N4O4/c1-15-24(3)17-30-31(35(47)43(34(30)46)28-22-38(9,10)41(14)39(11,12)23-28)19-26(16-2)18-29-25(4)32(44)42(33(29)45)27-20-36(5,6)40(13)37(7,8)21-27/h24-31H,15-23H2,1-14H3
InChIKeyQHHDUTRYCVQGFJ-UHFFFAOYSA-N
MW657.00 g/mol
LogP6.75
Rot. Bonds10

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

3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione (PubChem CID 20768150) has the molecular formula C39H68N4O4 and a molecular weight of 657.00 g/mol. Its IUPAC name is 3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione
PubChem CID20768150
Molecular FormulaC39H68N4O4
Molecular Weight657.00 g/mol
Exact Mass656.52
IUPAC Name3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESCCC(C)CC1C(=O)N(C2CC(C)(C)N(C)C(C)(C)C2)C(=O)C1CC(CC)CC1C(=O)N(C2CC(C)(C)N(C)C(C)(C)C2)C(=O)C1C
InChIInChI=1S/C39H68N4O4/c1-15-24(3)17-30-31(35(47)43(34(30)46)28-22-38(9,10)41(14)39(11,12)23-28)19-26(16-2)18-29-25(4)32(44)42(33(29)45)27-20-36(5,6)40(13)37(7,8)21-27/h24-31H,15-23H2,1-14H3
InChIKeyQHHDUTRYCVQGFJ-UHFFFAOYSA-N
XLogP6.75
TPSA81.24 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500657.00
LogP ≤ 56.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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

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Related Compounds

2,5-Pyrrolidinedione, 1-(1-acetyl-2,2,6,6-tetramethyl-4-piperidinyl)-3-dodecyl-
CID 3034263
2,5-Pyrrolidinedione, 3-dodecyl-1-(1,2,2,6,6-pentamethyl-4-piperidinyl)-
CID 86098
3-[2,5-Dioxo-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
CID 14365941
3-Dodecyl-1-[1-[8-[4-(3-dodecyl-2,5-dioxopyrrolidin-1-yl)-2,2,6,6-tetramethylpiperidin-1-yl]oxyoctoxy]-2,2,6,6-tetramethylpiperidin-4-yl]pyrrolidine-2,5-dione
CID 15170000
3-[2-[4-(2,2-Dimethylpropyl)-1-ethyl-2,5-dioxopyrrolidin-3-yl]-2-methylpropyl]-4-methyl-1-[(1,2,2,6,6-pentamethylpiperidin-4-yl)methyl]pyrrolidine-2,5-dione
CID 18715873
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
1-(1-Methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-3-[2-[1-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(2-methylbutyl)-2,5-dioxopyrrolidin-3-yl]butyl]-4-methylpyrrolidine-2,5-dione
CID 18716416
3-Methyl-4-[2-[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione
CID 18716441
2-[3-methyl-4-[2-[4-(2-methyloctadecyl)-2,5-dioxo-1-[2-oxo-2-[(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]acetyl]pyrrolidin-3-yl]octadecyl]-2,5-dioxopyrrolidin-1-yl]-2-oxo-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide
CID 20768147
3-Dodecyl-1-(1,2,2,3,3-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione
CID 22171859
3-Ethyl-4-[2-[4-(2-ethylbutyl)-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 53693766
CID 59113765
CID 59113765

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The IUPAC name of 3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione (CID 20768150) is 3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The canonical SMILES for 3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione is CCC(C)CC1C(=O)N(C2CC(C)(C)N(C)C(C)(C)C2)C(=O)C1CC(CC)CC1C(=O)N(C2CC(C)(C)N(C)C(C)(C)C2)C(=O)C1C.
What is the InChIKey of 3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The InChIKey is QHHDUTRYCVQGFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H68N4O4/c1-15-24(3)17-30-31(35(47)43(34(30)46)28-22-38(9,10)41(14)39(11,12)23-28)19-26(16-2)18-29-25(4)32(44)42(33(29)45)27-20-36(5,6)40(13)37(7,8)21-27/h24-31H,15-23H2,1-14H3.
What are the key properties of 3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione?
3-methyl-4-[2-[[4-(2-methylbutyl)-2,5-dioxo-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione has a molecular weight of 657.00 g/mol, XLogP of 6.75, 10 rotatable bonds, 0 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-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]butyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione is sourced from PubChem (CID 20768150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).