2-[2-(dimethylamino)ethoxy]ethyl hypoiodite

C6H14INO2 — CID 138660148

IUPAC2-[2-(dimethylamino)ethoxy]ethyl hypoiodite
SMILESCN(C)CCOCCOI
InChIInChI=1S/C6H14INO2/c1-8(2)3-4-9-5-6-10-7/h3-6H2,1-2H3
InChIKeyCOEPULWJEAYJFB-UHFFFAOYSA-N
MW259.09 g/mol
LogP0.93
Rot. Bonds6

About 2-[2-(dimethylamino)ethoxy]ethyl hypoiodite

2-[2-(dimethylamino)ethoxy]ethyl hypoiodite (PubChem CID 138660148) has the molecular formula C6H14INO2 and a molecular weight of 259.09 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethoxy]ethyl hypoiodite.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethoxy]ethyl hypoiodite
PubChem CID138660148
Molecular FormulaC6H14INO2
Molecular Weight259.09 g/mol
Exact Mass259.01
IUPAC Name2-[2-(dimethylamino)ethoxy]ethyl hypoiodite
SMILESCN(C)CCOCCOI
InChIInChI=1S/C6H14INO2/c1-8(2)3-4-9-5-6-10-7/h3-6H2,1-2H3
InChIKeyCOEPULWJEAYJFB-UHFFFAOYSA-N
XLogP0.93
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.09
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethoxy]ethyl hypoiodite?
The IUPAC name of 2-[2-(dimethylamino)ethoxy]ethyl hypoiodite (CID 138660148) is 2-[2-(dimethylamino)ethoxy]ethyl hypoiodite.
What is the SMILES notation for 2-[2-(dimethylamino)ethoxy]ethyl hypoiodite?
The canonical SMILES for 2-[2-(dimethylamino)ethoxy]ethyl hypoiodite is CN(C)CCOCCOI.
What is the InChIKey of 2-[2-(dimethylamino)ethoxy]ethyl hypoiodite?
The InChIKey is COEPULWJEAYJFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14INO2/c1-8(2)3-4-9-5-6-10-7/h3-6H2,1-2H3.
What are the key properties of 2-[2-(dimethylamino)ethoxy]ethyl hypoiodite?
2-[2-(dimethylamino)ethoxy]ethyl hypoiodite has a molecular weight of 259.09 g/mol, XLogP of 0.93, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethoxy]ethyl hypoiodite is sourced from PubChem (CID 138660148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).