2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide

C10H24INO3 — CID 167445578

IUPAC2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide
SMILESCOCCOCC[N+](C)(C)CCOC.[I-]
InChIInChI=1S/C10H24NO3.HI/c1-11(2,5-7-12-3)6-8-14-10-9-13-4;/h5-10H2,1-4H3;1H/q+1;/p-1
InChIKeyGOJKCTBUNFDRER-UHFFFAOYSA-M
MW333.21 g/mol
LogP-2.62
Rot. Bonds9

About 2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide

2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide (PubChem CID 167445578) has the molecular formula C10H24INO3 and a molecular weight of 333.21 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide.

Molecular Properties

Compound Name2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide
PubChem CID167445578
Molecular FormulaC10H24INO3
Molecular Weight333.21 g/mol
Exact Mass333.08
IUPAC Name2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide
SMILESCOCCOCC[N+](C)(C)CCOC.[I-]
InChIInChI=1S/C10H24NO3.HI/c1-11(2,5-7-12-3)6-8-14-10-9-13-4;/h5-10H2,1-4H3;1H/q+1;/p-1
InChIKeyGOJKCTBUNFDRER-UHFFFAOYSA-M
XLogP-2.62
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.21
LogP ≤ 5-2.62
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'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

bis[2-(2-methoxyethoxy)ethyl]-dimethylazanium chloride
CID 129073269
hydrogen carbonate;2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium
CID 171569271
carboxymethyl-[2-(2-methoxyethoxy)ethyl]-dimethylazanium
CID 146852079
bis(bis(2-methoxyethyl)-dimethylazanium);carbonate
CID 87147133
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87439194
1,2-dimethoxyethane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 159847962
fluoromethyl-(2-methoxyethyl)-dimethylazanium iodide
CID 146629304
bis[2-(2-ethoxyethoxy)ethyl]-dimethylazanium
CID 87738148
diethyl-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-methylazanium
CID 90306950
2-ethoxyethyl-[2-(2-methoxyethoxy)ethyl]-dimethylazanium;3-[2-(2-methoxyethoxy)ethoxy]propanoate
CID 118645100
bis(2-ethoxyethyl)-dimethylazanium;3-[2-(2-methoxyethoxy)ethoxy]propanoate
CID 118645288

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide?
The IUPAC name of 2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide (CID 167445578) is 2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide.
What is the SMILES notation for 2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide?
The canonical SMILES for 2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide is COCCOCC[N+](C)(C)CCOC.[I-].
What is the InChIKey of 2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide?
The InChIKey is GOJKCTBUNFDRER-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H24NO3.HI/c1-11(2,5-7-12-3)6-8-14-10-9-13-4;/h5-10H2,1-4H3;1H/q+1;/p-1.
What are the key properties of 2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide?
2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide has a molecular weight of 333.21 g/mol, XLogP of -2.62, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide is sourced from PubChem (CID 167445578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).