4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane

C59H98N2O3 — CID 143485767

About 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane

4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane (PubChem CID 143485767) has the molecular formula C59H98N2O3 and a molecular weight of 883.44 g/mol. Its IUPAC name is 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane.

Molecular Properties

• Compound Name: 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane
• PubChem CID: 143485767
• Molecular Formula: C59H98N2O3
• Molecular Weight: 883.44 g/mol
• Exact Mass: 882.76
• IUPAC Name: 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane
• SMILES: C=C(OC(Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1)(C(=C)OC1CC(C)(C)N(C)C(C)(C)C1)C(=C)OC1CC(C)(C)N(C)C(C)(C)C1)c1cc(C(C)(C)C)c(C)c(C(C)(C)C)c1.CC
• InChI: InChI=1S/C57H92N2O3.C2H6/c1-37-47(51(11,12)13)29-42(30-48(37)52(14,15)16)38(2)62-57(39(3)60-45-33-53(17,18)58(25)54(19,20)34-45,40(4)61-46-35-55(21,22)59(26)56(23,24)36-46)32-41-27-43(49(5,6)7)31-44(28-41)50(8,9)10;1-2/h27-31,45-46H,2-4,32-36H2,1,5-26H3;1-2H3
• InChIKey: YVEDRWOBJDLPJM-UHFFFAOYSA-N
• XLogP: 15.54
• TPSA: 34.17 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 11
• Heavy Atoms: 64
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	883.44
LogP ≤ 5	15.54
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane?

The IUPAC name of 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane (CID 143485767) is 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane.

What is the SMILES notation for 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane?

The canonical SMILES for 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane is C=C(OC(Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1)(C(=C)OC1CC(C)(C)N(C)C(C)(C)C1)C(=C)OC1CC(C)(C)N(C)C(C)(C)C1)c1cc(C(C)(C)C)c(C)c(C(C)(C)C)c1.CC.

What is the InChIKey of 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane?

The InChIKey is YVEDRWOBJDLPJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H92N2O3.C2H6/c1-37-47(51(11,12)13)29-42(30-48(37)52(14,15)16)38(2)62-57(39(3)60-45-33-53(17,18)58(25)54(19,20)34-45,40(4)61-46-35-55(21,22)59(26)56(23,24)36-46)32-41-27-43(49(5,6)7)31-44(28-41)50(8,9)10;1-2/h27-31,45-46H,2-4,32-36H2,1,5-26H3;1-2H3.

What are the key properties of 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane?

4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane has a molecular weight of 883.44 g/mol, XLogP of 15.54, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[3-[1-(3,5-ditert-butyl-4-methylphenyl)ethenoxy]-3-[(3,5-ditert-butylphenyl)methyl]-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypenta-1,4-dien-2-yl]oxy-1,2,2,6,6-pentamethylpiperidine;ethane is sourced from PubChem (CID 143485767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).