2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide

C34H69NO17 — CID 141360570

About 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide

2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide (PubChem CID 141360570) has the molecular formula C34H69NO17 and a molecular weight of 763.92 g/mol. Its IUPAC name is 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide.

Molecular Properties

• Compound Name: 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide
• PubChem CID: 141360570
• Molecular Formula: C34H69NO17
• Molecular Weight: 763.92 g/mol
• Exact Mass: 763.46
• IUPAC Name: 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide
• SMILES: COCCOCCOCCOCCOCC(COCCOCCOCCOCCOC)OCCOCCOCCOCCOCCCOCC(N)=O
• InChI: InChI=1S/C34H69NO17/c1-37-6-8-40-12-14-43-18-20-46-24-26-50-30-33(31-51-27-25-47-21-19-44-15-13-41-9-7-38-2)52-29-28-48-23-22-45-17-16-42-11-10-39-4-3-5-49-32-34(35)36/h33H,3-32H2,1-2H3,(H2,35,36)
• InChIKey: LKHIYBOAUDZITR-UHFFFAOYSA-N
• XLogP: -0.24
• TPSA: 190.77 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 17
• Rotatable Bonds: 47
• Heavy Atoms: 52
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	763.92
LogP ≤ 5	-0.24
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide?

The IUPAC name of 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide (CID 141360570) is 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide.

What is the SMILES notation for 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide?

The canonical SMILES for 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide is COCCOCCOCCOCCOCC(COCCOCCOCCOCCOC)OCCOCCOCCOCCOCCCOCC(N)=O.

What is the InChIKey of 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide?

The InChIKey is LKHIYBOAUDZITR-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H69NO17/c1-37-6-8-40-12-14-43-18-20-46-24-26-50-30-33(31-51-27-25-47-21-19-44-15-13-41-9-7-38-2)52-29-28-48-23-22-45-17-16-42-11-10-39-4-3-5-49-32-34(35)36/h33H,3-32H2,1-2H3,(H2,35,36).

What are the key properties of 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide?

2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide has a molecular weight of 763.92 g/mol, XLogP of -0.24, 47 rotatable bonds, 1 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[2-[2-[2-[2-[1,3-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-yloxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]acetamide is sourced from PubChem (CID 141360570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).