10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide

C34H35IN2O3 — CID 174674482

About 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide

10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide (PubChem CID 174674482) has the molecular formula C34H35IN2O3 and a molecular weight of 646.57 g/mol. Its IUPAC name is 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide.

Molecular Properties

• Compound Name: 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide
• PubChem CID: 174674482
• Molecular Formula: C34H35IN2O3
• Molecular Weight: 646.57 g/mol
• Exact Mass: 646.17
• IUPAC Name: 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide
• SMILES: CCON1c2ccccc2C(C=Cc2ccc3c(c2)c2ccccc2n3CCOCCOC)c2ccccc21.I
• InChI: InChI=1S/C34H34N2O3.HI/c1-3-39-36-33-14-8-5-10-27(33)26(28-11-6-9-15-34(28)36)18-16-25-17-19-32-30(24-25)29-12-4-7-13-31(29)35(32)20-21-38-23-22-37-2;/h4-19,24,26H,3,20-23H2,1-2H3;1H
• InChIKey: AUNKQTUFSAJFES-UHFFFAOYSA-N
• XLogP: 8.32
• TPSA: 35.86 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	646.57
LogP ≤ 5	8.32
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide?

The IUPAC name of 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide (CID 174674482) is 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide.

What is the SMILES notation for 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide?

The canonical SMILES for 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide is CCON1c2ccccc2C(C=Cc2ccc3c(c2)c2ccccc2n3CCOCCOC)c2ccccc21.I.

What is the InChIKey of 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide?

The InChIKey is AUNKQTUFSAJFES-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H34N2O3.HI/c1-3-39-36-33-14-8-5-10-27(33)26(28-11-6-9-15-34(28)36)18-16-25-17-19-32-30(24-25)29-12-4-7-13-31(29)35(32)20-21-38-23-22-37-2;/h4-19,24,26H,3,20-23H2,1-2H3;1H.

What are the key properties of 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide?

10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide has a molecular weight of 646.57 g/mol, XLogP of 8.32, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 10-ethoxy-9-[2-[9-[2-(2-methoxyethoxy)ethyl]carbazol-3-yl]ethenyl]-9H-acridine;hydroiodide is sourced from PubChem (CID 174674482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).