bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate

C141H258N8O39Si8 — CID 160686882

About bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate

bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate (PubChem CID 160686882) has the molecular formula C141H258N8O39Si8 and a molecular weight of 2914.32 g/mol. Its IUPAC name is bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate.

Molecular Properties

• Compound Name: bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate
• PubChem CID: 160686882
• Molecular Formula: C141H258N8O39Si8
• Molecular Weight: 2914.32 g/mol
• Exact Mass: 2911.66
• IUPAC Name: bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate
• SMILES: C=CC(=O)OCCOC(=O)CCC1(C)CC(NC(=O)OCCCCOC(=O)CCC2(C)CC(NC(=O)OCC(COCCC[Si](C)(C)O[Si](C)(C)C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCC)OC(=O)CCC3(C)CC(NC(=O)OCCOC(=O)C=C)CC(C)(C)C3)CC(C)(C)C2)CC(C)(C)C1.C=CC(=O)OCCOC(=O)NCC1CC2CCC1C2.C=CC(=O)OCCOC(=O)NCC1CC2CCC1C2.CCCC(=O)OCCCCOC(=O)NCC.CCNC(=O)OCC(CC)(COCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C)COC(=O)NCC1CC2CCC1C2
• InChI: InChI=1S/C74H137N3O20Si5.C28H58N2O7Si3.2C14H21NO4.C11H21NO4/c1-23-26-43-99(15,16)96-102(21,22)97-101(19,20)56-100(17,18)95-98(13,14)44-29-36-86-51-60(94-65(82)32-35-74(12)49-58(46-70(6,7)55-74)76-67(84)92-42-41-89-62(79)25-3)52-93-68(85)77-59-47-71(8,9)54-72(10,50-59)33-30-63(80)87-37-27-28-38-91-66(83)75-57-45-69(4,5)53-73(11,48-57)34-31-64(81)90-40-39-88-61(78)24-2;1-10-28(21-34-26(31)29-11-2,22-35-27(32)30-19-25-18-23-13-14-24(25)17-23)20-33-15-12-16-40(9,36-38(3,4)5)37-39(6,7)8;2*1-2-13(16)18-5-6-19-14(17)15-9-12-8-10-3-4-11(12)7-10;1-3-7-10(13)15-8-5-6-9-16-11(14)12-4-2/h24-25,57-60H,2-3,23,26-56H2,1,4-22H3,(H,75,83)(H,76,84)(H,77,85);23-25H,10-22H2,1-9H3,(H,29,31)(H,30,32);2*2,10-12H,1,3-9H2,(H,15,17);3-9H2,1-2H3,(H,12,14)
• InChIKey: ROWOCHAXTDTJBX-UHFFFAOYSA-N
• XLogP: 27.90
• TPSA: 581.65 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 39
• Rotatable Bonds: 83
• Heavy Atoms: 196
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2914.32
LogP ≤ 5	27.90
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', '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 bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate?

The IUPAC name of bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate (CID 160686882) is bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate.

What is the SMILES notation for bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate?

The canonical SMILES for bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate is C=CC(=O)OCCOC(=O)CCC1(C)CC(NC(=O)OCCCCOC(=O)CCC2(C)CC(NC(=O)OCC(COCCC[Si](C)(C)O[Si](C)(C)C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCC)OC(=O)CCC3(C)CC(NC(=O)OCCOC(=O)C=C)CC(C)(C)C3)CC(C)(C)C2)CC(C)(C)C1.C=CC(=O)OCCOC(=O)NCC1CC2CCC1C2.C=CC(=O)OCCOC(=O)NCC1CC2CCC1C2.CCCC(=O)OCCCCOC(=O)NCC.CCNC(=O)OCC(CC)(COCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C)COC(=O)NCC1CC2CCC1C2.

What is the InChIKey of bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate?

The InChIKey is ROWOCHAXTDTJBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H137N3O20Si5.C28H58N2O7Si3.2C14H21NO4.C11H21NO4/c1-23-26-43-99(15,16)96-102(21,22)97-101(19,20)56-100(17,18)95-98(13,14)44-29-36-86-51-60(94-65(82)32-35-74(12)49-58(46-70(6,7)55-74)76-67(84)92-42-41-89-62(79)25-3)52-93-68(85)77-59-47-71(8,9)54-72(10,50-59)33-30-63(80)87-37-27-28-38-91-66(83)75-57-45-69(4,5)53-73(11,48-57)34-31-64(81)90-40-39-88-61(78)24-2;1-10-28(21-34-26(31)29-11-2,22-35-27(32)30-19-25-18-23-13-14-24(25)17-23)20-33-15-12-16-40(9,36-38(3,4)5)37-39(6,7)8;2*1-2-13(16)18-5-6-19-14(17)15-9-12-8-10-3-4-11(12)7-10;1-3-7-10(13)15-8-5-6-9-16-11(14)12-4-2/h24-25,57-60H,2-3,23,26-56H2,1,4-22H3,(H,75,83)(H,76,84)(H,77,85);23-25H,10-22H2,1-9H3,(H,29,31)(H,30,32);2*2,10-12H,1,3-9H2,(H,15,17);3-9H2,1-2H3,(H,12,14).

What are the key properties of bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate?

bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate has a molecular weight of 2914.32 g/mol, XLogP of 27.90, 83 rotatable bonds, 8 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-(2-bicyclo[2.2.1]heptanylmethylcarbamoyloxy)ethyl prop-2-enoate);4-(ethylcarbamoyloxy)butyl butanoate;[2-(ethylcarbamoyloxymethyl)-2-[3-[methyl-bis(trimethylsilyloxy)silyl]propoxymethyl]butyl] N-(2-bicyclo[2.2.1]heptanylmethyl)carbamate;4-[[3,3,5-trimethyl-5-[3-oxo-3-(2-prop-2-enoyloxyethoxy)propyl]cyclohexyl]carbamoyloxy]butyl 3-[5-[[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-[3-[1,3,3-trimethyl-5-(2-prop-2-enoyloxyethoxycarbonylamino)cyclohexyl]propanoyloxy]propoxy]carbonylamino]-1,3,3-trimethylcyclohexyl]propanoate is sourced from PubChem (CID 160686882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).