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

C70H124N6O8 — CID 20768147

About 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

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 (PubChem CID 20768147) has the molecular formula C70H124N6O8 and a molecular weight of 1177.80 g/mol. Its IUPAC name is 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.

Molecular Properties

• Compound Name: 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
• PubChem CID: 20768147
• Molecular Formula: C70H124N6O8
• Molecular Weight: 1177.80 g/mol
• Exact Mass: 1176.95
• IUPAC Name: 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
• SMILES: CCCCCCCCCCCCCCCCC(C)CC1C(=O)N(C(=O)C(=O)NC2CC(C)(C)N(C)C(C)(C)C2)C(=O)C1C(CCCCCCCCCCCCCCCC)CC1C(=O)N(C(=O)C(=O)NC2CC(C)(C)N(C)C(C)(C)C2)C(=O)C1C
• InChI: InChI=1S/C70H124N6O8/c1-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-51(3)45-57-58(64(82)76(63(57)81)66(84)60(78)72-55-49-69(9,10)74(14)70(11,12)50-55)53(44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-2)46-56-52(4)61(79)75(62(56)80)65(83)59(77)71-54-47-67(5,6)73(13)68(7,8)48-54/h51-58H,15-50H2,1-14H3,(H,71,77)(H,72,78)
• InChIKey: FSIFRKRQDRSBCB-UHFFFAOYSA-N
• XLogP: 14.57
• TPSA: 173.58 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 10
• Rotatable Bonds: 37
• Heavy Atoms: 84
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1177.80
LogP ≤ 5	14.57
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 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?

The IUPAC name of 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) is 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.

What is the SMILES notation for 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?

The canonical SMILES for 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 is CCCCCCCCCCCCCCCCC(C)CC1C(=O)N(C(=O)C(=O)NC2CC(C)(C)N(C)C(C)(C)C2)C(=O)C1C(CCCCCCCCCCCCCCCC)CC1C(=O)N(C(=O)C(=O)NC2CC(C)(C)N(C)C(C)(C)C2)C(=O)C1C.

What is the InChIKey of 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?

The InChIKey is FSIFRKRQDRSBCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H124N6O8/c1-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-51(3)45-57-58(64(82)76(63(57)81)66(84)60(78)72-55-49-69(9,10)74(14)70(11,12)50-55)53(44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-2)46-56-52(4)61(79)75(62(56)80)65(83)59(77)71-54-47-67(5,6)73(13)68(7,8)48-54/h51-58H,15-50H2,1-14H3,(H,71,77)(H,72,78).

What are the key properties of 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?

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 has a molecular weight of 1177.80 g/mol, XLogP of 14.57, 37 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 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 is sourced from PubChem (CID 20768147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).