3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine)

C113H162N12O36Si8 — CID 161324445

About 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine)

3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine) (PubChem CID 161324445) has the molecular formula C113H162N12O36Si8 and a molecular weight of 2489.27 g/mol. Its IUPAC name is 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine).

Molecular Properties

• Compound Name: 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine)
• PubChem CID: 161324445
• Molecular Formula: C113H162N12O36Si8
• Molecular Weight: 2489.27 g/mol
• Exact Mass: 2486.94
• IUPAC Name: 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine)
• SMILES: COC(=O)CCc1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1.CO[Si](CCCN)(OC)OC.CO[Si](CCCN)(OC)OC.CO[Si](CCCN)(OC)OC.CO[Si](CCCN)(OC)OC.CO[Si](CCCNC(=O)CCc1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1)(OC)OC.COc1ccc2oc3ccc4c(=O)n(CCC[Si](OC)(OC)OC)c(=O)c5ccc(c2c1)c3c45.COc1ccc2oc3ccc4c(=O)oc(=O)c5ccc(c2c1)c3c45.O=[Si]=O.O=[Si]=O
• InChI: InChI=1S/C25H36N4O5Si.C25H25NO7Si.C20H23N3O3.C19H10O5.4C6H17NO3Si.2O2Si/c1-25(2,3)19-16-18(12-13-23(30)26-14-9-15-35(32-4,33-5)34-6)17-22(24(19)31)29-27-20-10-7-8-11-21(20)28-29;1-29-15-6-10-20-19(14-15)16-7-8-17-22-18(9-11-21(33-20)23(16)22)25(28)26(24(17)27)12-5-13-34(30-2,31-3)32-4;1-20(2,3)14-11-13(9-10-18(24)26-4)12-17(19(14)25)23-21-15-7-5-6-8-16(15)22-23;1-22-9-2-6-14-13(8-9)10-3-4-11-16-12(19(21)24-18(11)20)5-7-15(23-14)17(10)16;4*1-8-11(9-2,10-3)6-4-5-7;2*1-3-2/h7-8,10-11,16-17,31H,9,12-15H2,1-6H3,(H,26,30);6-11,14H,5,12-13H2,1-4H3;5-8,11-12,25H,9-10H2,1-4H3;2-8H,1H3;4*4-7H2,1-3H3
• InChIKey: VKORZHQYOIVMSG-UHFFFAOYSA-N
• XLogP: 14.67
• TPSA: 626.87 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 47
• Rotatable Bonds: 48
• Heavy Atoms: 169
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2489.27
LogP ≤ 5	14.67
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	47

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine)?

The IUPAC name of 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine) (CID 161324445) is 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine).

What is the SMILES notation for 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine)?

The canonical SMILES for 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine) is COC(=O)CCc1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1.CO[Si](CCCN)(OC)OC.CO[Si](CCCN)(OC)OC.CO[Si](CCCN)(OC)OC.CO[Si](CCCN)(OC)OC.CO[Si](CCCNC(=O)CCc1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1)(OC)OC.COc1ccc2oc3ccc4c(=O)n(CCC[Si](OC)(OC)OC)c(=O)c5ccc(c2c1)c3c45.COc1ccc2oc3ccc4c(=O)oc(=O)c5ccc(c2c1)c3c45.O=[Si]=O.O=[Si]=O.

What is the InChIKey of 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine)?

The InChIKey is VKORZHQYOIVMSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H36N4O5Si.C25H25NO7Si.C20H23N3O3.C19H10O5.4C6H17NO3Si.2O2Si/c1-25(2,3)19-16-18(12-13-23(30)26-14-9-15-35(32-4,33-5)34-6)17-22(24(19)31)29-27-20-10-7-8-11-21(20)28-29;1-29-15-6-10-20-19(14-15)16-7-8-17-22-18(9-11-21(33-20)23(16)22)25(28)26(24(17)27)12-5-13-34(30-2,31-3)32-4;1-20(2,3)14-11-13(9-10-18(24)26-4)12-17(19(14)25)23-21-15-7-5-6-8-16(15)22-23;1-22-9-2-6-14-13(8-9)10-3-4-11-16-12(19(21)24-18(11)20)5-7-15(23-14)17(10)16;4*1-8-11(9-2,10-3)6-4-5-7;2*1-3-2/h7-8,10-11,16-17,31H,9,12-15H2,1-6H3,(H,26,30);6-11,14H,5,12-13H2,1-4H3;5-8,11-12,25H,9-10H2,1-4H3;2-8H,1H3;4*4-7H2,1-3H3;;.

What are the key properties of 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine)?

3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine) has a molecular weight of 2489.27 g/mol, XLogP of 14.67, 48 rotatable bonds, 7 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-trimethoxysilylpropyl)propanamide;bis(dioxosilane);4-methoxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;4-methoxy-14-(3-trimethoxysilylpropyl)-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;tetrakis(3-trimethoxysilylpropan-1-amine) is sourced from PubChem (CID 161324445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).