[1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate

C136H258N18O34Si2 — CID 146730613

About [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate

[1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate (PubChem CID 146730613) has the molecular formula C136H258N18O34Si2 and a molecular weight of 2745.82 g/mol. Its IUPAC name is [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate.

Molecular Properties

• Compound Name: [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate
• PubChem CID: 146730613
• Molecular Formula: C136H258N18O34Si2
• Molecular Weight: 2745.82 g/mol
• Exact Mass: 2743.86
• IUPAC Name: [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate
• SMILES: CCNC(=O)OC(CNCCNCC(COC1CCC(C(C)(C)C2CCC(OCC(CN(C)CCOC(=O)NCCC[Si](OC)(OC)OC)OC(=O)NCC)CC2)CC1)OC(=O)NCC)COC1CCC(C(C)(C)C2CCC(OCC(CNCCNCC(COC3CCC(C(C)(C)C4CCC(OCC(CN5CCN(CC(COC6CCC(C(C)(C)C7CCC(OCC(CN(C)CCOC(=O)NCCC[Si](OC)(OC)OC)OC(=O)NCC)CC7)CC6)OC(=O)NCC)CC5)OC(=O)NCC)CC4)CC3)OC(=O)NCC)OC(=O)NCC)CC2)CC1
• InChI: InChI=1S/C136H258N18O34Si2/c1-25-141-125(157)181-115(83-137-69-71-139-85-117(183-127(159)143-27-3)93-175-109-55-39-101(40-56-109)134(11,12)103-43-59-111(60-44-103)177-95-119(185-129(161)145-29-5)87-151(17)77-79-171-123(155)149-67-33-81-189(165-19,166-20)167-21)91-173-107-51-35-99(36-52-107)133(9,10)100-37-53-108(54-38-100)174-92-116(182-126(158)142-26-2)84-138-70-72-140-86-118(184-128(160)144-28-4)94-176-110-57-41-102(42-58-110)135(13,14)105-47-63-113(64-48-105)179-97-121(187-131(163)147-31-7)89-153-73-75-154(76-74-153)90-122(188-132(164)148-32-8)98-180-114-65-49-106(50-66-114)136(15,16)104-45-61-112(62-46-104)178-96-120(186-130(162)146-30-6)88-152(18)78-80-172-124(156)150-68-34-82-190(168-22,169-23)170-24/h99-122,137-140H,25-98H2,1-24H3,(H,141,157)(H,142,158)(H,143,159)(H,144,160)(H,145,161)(H,146,162)(H,147,163)(H,148,164)(H,149,155)(H,150,156)
• InChIKey: RHLCEYPJIFABJX-UHFFFAOYSA-N
• XLogP: 16.44
• TPSA: 573.60 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 42
• Rotatable Bonds: 90
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2745.82
LogP ≤ 5	16.44
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	42

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'}

Frequently Asked Questions

What is the IUPAC name of [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate?

The IUPAC name of [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate (CID 146730613) is [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate.

What is the SMILES notation for [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate?

The canonical SMILES for [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate is CCNC(=O)OC(CNCCNCC(COC1CCC(C(C)(C)C2CCC(OCC(CN(C)CCOC(=O)NCCC[Si](OC)(OC)OC)OC(=O)NCC)CC2)CC1)OC(=O)NCC)COC1CCC(C(C)(C)C2CCC(OCC(CNCCNCC(COC3CCC(C(C)(C)C4CCC(OCC(CN5CCN(CC(COC6CCC(C(C)(C)C7CCC(OCC(CN(C)CCOC(=O)NCCC[Si](OC)(OC)OC)OC(=O)NCC)CC7)CC6)OC(=O)NCC)CC5)OC(=O)NCC)CC4)CC3)OC(=O)NCC)OC(=O)NCC)CC2)CC1.

What is the InChIKey of [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate?

The InChIKey is RHLCEYPJIFABJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C136H258N18O34Si2/c1-25-141-125(157)181-115(83-137-69-71-139-85-117(183-127(159)143-27-3)93-175-109-55-39-101(40-56-109)134(11,12)103-43-59-111(60-44-103)177-95-119(185-129(161)145-29-5)87-151(17)77-79-171-123(155)149-67-33-81-189(165-19,166-20)167-21)91-173-107-51-35-99(36-52-107)133(9,10)100-37-53-108(54-38-100)174-92-116(182-126(158)142-26-2)84-138-70-72-140-86-118(184-128(160)144-28-4)94-176-110-57-41-102(42-58-110)135(13,14)105-47-63-113(64-48-105)179-97-121(187-131(163)147-31-7)89-153-73-75-154(76-74-153)90-122(188-132(164)148-32-8)98-180-114-65-49-106(50-66-114)136(15,16)104-45-61-112(62-46-104)178-96-120(186-130(162)146-30-6)88-152(18)78-80-172-124(156)150-68-34-82-190(168-22,169-23)170-24/h99-122,137-140H,25-98H2,1-24H3,(H,141,157)(H,142,158)(H,143,159)(H,144,160)(H,145,161)(H,146,162)(H,147,163)(H,148,164)(H,149,155)(H,150,156).

What are the key properties of [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate?

[1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate has a molecular weight of 2745.82 g/mol, XLogP of 16.44, 90 rotatable bonds, 14 hydrogen bond donors, and 42 hydrogen bond acceptors.

Where does this data come from?

All data for [1-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]piperazin-1-yl]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[2-[[2-(ethylcarbamoyloxy)-3-[4-[2-[4-[2-(ethylcarbamoyloxy)-3-[methyl-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethyl]amino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropyl]amino]ethylamino]propoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-2-yl] N-ethylcarbamate is sourced from PubChem (CID 146730613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).