2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide

C109H192N4O42 — CID 158721615

About 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide

2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide (PubChem CID 158721615) has the molecular formula C109H192N4O42 and a molecular weight of 2230.72 g/mol. Its IUPAC name is 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide.

Molecular Properties

• Compound Name: 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide
• PubChem CID: 158721615
• Molecular Formula: C109H192N4O42
• Molecular Weight: 2230.72 g/mol
• Exact Mass: 2229.30
• IUPAC Name: 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide
• SMILES: NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO.O=C(COC1CC/C=C\CCC1)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO.O=C(COC1CC/C=C\CCC1)OC1C(=O)CCC1=O.O=C(NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)C1[C@H]2CC/C=C\CC[C@@H]12.O=C(ON1C(=O)CCC1=O)C1[C@H]2CC/C=C\CC[C@@H]12
• InChI: InChI=1S/C30H57NO12.C30H55NO11.C20H43NO10.C15H20O5.C14H17NO4/c32-9-11-35-13-15-37-17-19-39-21-23-41-25-27-42-26-24-40-22-20-38-18-16-36-14-12-34-10-8-31-30(33)28-43-29-6-4-2-1-3-5-7-29;32-8-10-35-12-14-37-16-18-39-20-22-41-24-26-42-25-23-40-21-19-38-17-15-36-13-11-34-9-7-31-30(33)29-27-5-3-1-2-4-6-28(27)29;21-1-3-23-5-7-25-9-11-27-13-15-29-17-19-31-20-18-30-16-14-28-12-10-26-8-6-24-4-2-22;16-12-8-9-13(17)15(12)20-14(18)10-19-11-6-4-2-1-3-5-7-11;16-11-7-8-12(17)15(11)19-14(18)13-9-5-3-1-2-4-6-10(9)13/h1-2,29,32H,3-28H2,(H,31,33);1-2,27-29,32H,3-26H2,(H,31,33);22H,1-21H2;1-2,11,15H,3-10H2;1-2,9-10,13H,3-8H2/b2*2-1-;;2*2-1-/t;27-,28+,29?;;;9-,10+,13?
• InChIKey: IJZIJXWCUYKMEI-WQZCSRSISA-N
• XLogP: 4.80
• TPSA: 536.70 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 43
• Rotatable Bonds: 96
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2230.72
LogP ≤ 5	4.80
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	43

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide?

The IUPAC name of 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide (CID 158721615) is 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide.

What is the SMILES notation for 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide?

The canonical SMILES for 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide is NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO.O=C(COC1CC/C=C\CCC1)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO.O=C(COC1CC/C=C\CCC1)OC1C(=O)CCC1=O.O=C(NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)C1[C@H]2CC/C=C\CC[C@@H]12.O=C(ON1C(=O)CCC1=O)C1[C@H]2CC/C=C\CC[C@@H]12.

What is the InChIKey of 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide?

The InChIKey is IJZIJXWCUYKMEI-WQZCSRSISA-N. The full InChI is InChI=1S/C30H57NO12.C30H55NO11.C20H43NO10.C15H20O5.C14H17NO4/c32-9-11-35-13-15-37-17-19-39-21-23-41-25-27-42-26-24-40-22-20-38-18-16-36-14-12-34-10-8-31-30(33)28-43-29-6-4-2-1-3-5-7-29;32-8-10-35-12-14-37-16-18-39-20-22-41-24-26-42-25-23-40-21-19-38-17-15-36-13-11-34-9-7-31-30(33)29-27-5-3-1-2-4-6-28(27)29;21-1-3-23-5-7-25-9-11-27-13-15-29-17-19-31-20-18-30-16-14-28-12-10-26-8-6-24-4-2-22;16-12-8-9-13(17)15(12)20-14(18)10-19-11-6-4-2-1-3-5-7-11;16-11-7-8-12(17)15(11)19-14(18)13-9-5-3-1-2-4-6-10(9)13/h1-2,29,32H,3-28H2,(H,31,33);1-2,27-29,32H,3-26H2,(H,31,33);22H,1-21H2;1-2,11,15H,3-10H2;1-2,9-10,13H,3-8H2/b2*2-1-;;2*2-1-/t;27-,28+,29?;;;9-,10+,13?.

What are the key properties of 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide?

2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide has a molecular weight of 2230.72 g/mol, XLogP of 4.80, 96 rotatable bonds, 6 hydrogen bond donors, and 43 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[(4E)-cyclooct-4-en-1-yl]oxy-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide;(2,5-dioxocyclopentyl) 2-[(4E)-cyclooct-4-en-1-yl]oxyacetate;(2,5-dioxopyrrolidin-1-yl) (1S,4E,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate;(1S,4E,8R)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]bicyclo[6.1.0]non-4-ene-9-carboxamide is sourced from PubChem (CID 158721615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).