[2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate

C92H174N2O33Si9 — CID 159869490

About [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate

[2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate (PubChem CID 159869490) has the molecular formula C92H174N2O33Si9 and a molecular weight of 2089.16 g/mol. Its IUPAC name is [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate.

Molecular Properties

• Compound Name: [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate
• PubChem CID: 159869490
• Molecular Formula: C92H174N2O33Si9
• Molecular Weight: 2089.16 g/mol
• Exact Mass: 2086.99
• IUPAC Name: [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate
• SMILES: C=C(C)C(=O)OCCCC(=O)OCC(CC)(COCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C)COC(=O)CCCOC(=O)C(=C)C.C=C(C)C(=O)OCCOCCCC(=O)OCC(COCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C)OC(=O)NCCOCCOC(=O)C(=C)C.C=CC(=C)OCCCC(=O)OCC(COCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C)OC(=O)NCCOC(=C)C=C
• InChI: InChI=1S/C32H61NO13Si3.C32H60O11Si3.C28H53NO9Si3/c1-26(2)30(35)41-21-19-38-16-12-14-29(34)43-25-28(44-32(37)33-15-18-39-20-22-42-31(36)27(3)4)24-40-17-13-23-49(11,45-47(5,6)7)46-48(8,9)10;1-13-32(24-40-28(33)17-14-20-38-30(35)26(2)3,25-41-29(34)18-15-21-39-31(36)27(4)5)23-37-19-16-22-46(12,42-44(6,7)8)43-45(9,10)11;1-12-24(3)33-19-14-16-27(30)35-23-26(36-28(31)29-17-20-34-25(4)13-2)22-32-18-15-21-41(11,37-39(5,6)7)38-40(8,9)10/h28H,1,3,12-25H2,2,4-11H3,(H,33,37);2,4,13-25H2,1,3,5-12H3;12-13,26H,1-4,14-23H2,5-11H3,(H,29,31)
• InChIKey: NSDRMKKQKADXEB-UHFFFAOYSA-N
• XLogP: 17.33
• TPSA: 407.05 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 33
• Rotatable Bonds: 77
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2089.16
LogP ≤ 5	17.33
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate?

The IUPAC name of [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate (CID 159869490) is [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate.

What is the SMILES notation for [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate?

The canonical SMILES for [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate is C=C(C)C(=O)OCCCC(=O)OCC(CC)(COCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C)COC(=O)CCCOC(=O)C(=C)C.C=C(C)C(=O)OCCOCCCC(=O)OCC(COCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C)OC(=O)NCCOCCOC(=O)C(=C)C.C=CC(=C)OCCCC(=O)OCC(COCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C)OC(=O)NCCOC(=C)C=C.

What is the InChIKey of [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate?

The InChIKey is NSDRMKKQKADXEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H61NO13Si3.C32H60O11Si3.C28H53NO9Si3/c1-26(2)30(35)41-21-19-38-16-12-14-29(34)43-25-28(44-32(37)33-15-18-39-20-22-42-31(36)27(3)4)24-40-17-13-23-49(11,45-47(5,6)7)46-48(8,9)10;1-13-32(24-40-28(33)17-14-20-38-30(35)26(2)3,25-41-29(34)18-15-21-39-31(36)27(4)5)23-37-19-16-22-46(12,42-44(6,7)8)43-45(9,10)11;1-12-24(3)33-19-14-16-27(30)35-23-26(36-28(31)29-17-20-34-25(4)13-2)22-32-18-15-21-41(11,37-39(5,6)7)38-40(8,9)10/h28H,1,3,12-25H2,2,4-11H3,(H,33,37);2,4,13-25H2,1,3,5-12H3;12-13,26H,1-4,14-23H2,5-11H3,(H,29,31).

What are the key properties of [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate?

[2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate has a molecular weight of 2089.16 g/mol, XLogP of 17.33, 77 rotatable bonds, 2 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for [2-(2-buta-1,3-dien-2-yloxyethylcarbamoyloxy)-3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 4-buta-1,3-dien-2-yloxybutanoate;[2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]-2-[4-(2-methylprop-2-enoyloxy)butanoyloxymethyl]butyl] 4-(2-methylprop-2-enoyloxy)butanoate;[3-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxy]-2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethylcarbamoyloxy]propyl] 4-[2-(2-methylprop-2-enoyloxy)ethoxy]butanoate is sourced from PubChem (CID 159869490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).