N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide

C38H62N8O8 — CID 18715887

IUPACN'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
SMILESCC(C)CC1C(=O)N(NC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)C(=O)C1C(C)CC1C(=O)N(NC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)C(=O)C1C
InChIInChI=1S/C38H62N8O8/c1-19(2)13-25-26(34(54)46(33(25)53)42-30(50)28(48)40-23-17-37(9,10)44-38(11,12)18-23)20(3)14-24-21(4)31(51)45(32(24)52)41-29(49)27(47)39-22-15-35(5,6)43-36(7,8)16-22/h19-26,43-44H,13-18H2,1-12H3,(H,39,47)(H,40,48)(H,41,49)(H,42,50)
InChIKeyCYPWWTLBTXOGMG-UHFFFAOYSA-N
MW758.96 g/mol
LogP1.19
Rot. Bonds9

About N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide

N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide (PubChem CID 18715887) has the molecular formula C38H62N8O8 and a molecular weight of 758.96 g/mol. Its IUPAC name is N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide.

Molecular Properties

Compound NameN'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
PubChem CID18715887
Molecular FormulaC38H62N8O8
Molecular Weight758.96 g/mol
Exact Mass758.47
IUPAC NameN'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
SMILESCC(C)CC1C(=O)N(NC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)C(=O)C1C(C)CC1C(=O)N(NC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)C(=O)C1C
InChIInChI=1S/C38H62N8O8/c1-19(2)13-25-26(34(54)46(33(25)53)42-30(50)28(48)40-23-17-37(9,10)44-38(11,12)18-23)20(3)14-24-21(4)31(51)45(32(24)52)41-29(49)27(47)39-22-15-35(5,6)43-36(7,8)16-22/h19-26,43-44H,13-18H2,1-12H3,(H,39,47)(H,40,48)(H,41,49)(H,42,50)
InChIKeyCYPWWTLBTXOGMG-UHFFFAOYSA-N
XLogP1.19
TPSA215.22 Ų
H-Bond Donors6
H-Bond Acceptors10
Rotatable Bonds9
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500758.96
LogP ≤ 51.19
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide with MolForge

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Related Compounds

N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N'-[3-[2-[1-[[2-[(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-2-oxoacetyl]amino]-4-(2-methylpropyl)-2,5-dioxopyrrolidin-3-yl]propyl]-4-methyl-2,5-dioxopyrrolidin-1-yl]oxamide
CID 18716461
N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxamide
CID 18716462
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
N'-[3-methyl-4-[2-[4-(2-methyloctadecyl)-2,5-dioxo-1-[[2-oxo-2-[(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]octadecyl]-2,5-dioxopyrrolidin-1-yl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxamide
CID 20768160
N'-(3-dodecyl-2,5-dioxopyrrolidin-1-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 21243435
N'-(3-octadecyl-2,5-dioxopyrrolidin-1-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 21243442
N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-N'-(3-dodecyl-2,5-dioxopyrrolidin-1-yl)oxamide
CID 21243446
N'-[3-methyl-4-[2-[4-(2-methyloctadecyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]octadecyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 58788045
N'-(3-octadecan-2-yl-2,5-dioxopyrrolidin-1-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 70396389
N'-(3-dodecan-2-yl-2,5-dioxopyrrolidin-1-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 70396486
N'-(2,5-dioxo-3-propan-2-ylpyrrolidin-1-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 71221945
N'-(3-butan-2-yl-2,5-dioxopyrrolidin-1-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 71221946

Frequently Asked Questions

What is the IUPAC name of N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide?
The IUPAC name of N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide (CID 18715887) is N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide.
What is the SMILES notation for N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide?
The canonical SMILES for N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide is CC(C)CC1C(=O)N(NC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)C(=O)C1C(C)CC1C(=O)N(NC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)C(=O)C1C.
What is the InChIKey of N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide?
The InChIKey is CYPWWTLBTXOGMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H62N8O8/c1-19(2)13-25-26(34(54)46(33(25)53)42-30(50)28(48)40-23-17-37(9,10)44-38(11,12)18-23)20(3)14-24-21(4)31(51)45(32(24)52)41-29(49)27(47)39-22-15-35(5,6)43-36(7,8)16-22/h19-26,43-44H,13-18H2,1-12H3,(H,39,47)(H,40,48)(H,41,49)(H,42,50).
What are the key properties of N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide?
N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide has a molecular weight of 758.96 g/mol, XLogP of 1.19, 9 rotatable bonds, 6 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[3-methyl-4-[2-[4-(2-methylpropyl)-2,5-dioxo-1-[[2-oxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]acetyl]amino]pyrrolidin-3-yl]propyl]-2,5-dioxopyrrolidin-1-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide is sourced from PubChem (CID 18715887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).