diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride

C10H24ClNO2 — CID 167445594

IUPACdiethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride
SMILESCC[N+](C)(CC)CCOCCOC.[Cl-]
InChIInChI=1S/C10H24NO2.ClH/c1-5-11(3,6-2)7-8-13-10-9-12-4;/h5-10H2,1-4H3;1H/q+1;/p-1
InChIKeyAWXPPLUKWOIBRY-UHFFFAOYSA-M
MW225.76 g/mol
LogP-1.86
Rot. Bonds8

About diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride

diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride (PubChem CID 167445594) has the molecular formula C10H24ClNO2 and a molecular weight of 225.76 g/mol. Its IUPAC name is diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride.

Molecular Properties

Compound Namediethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride
PubChem CID167445594
Molecular FormulaC10H24ClNO2
Molecular Weight225.76 g/mol
Exact Mass225.15
IUPAC Namediethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride
SMILESCC[N+](C)(CC)CCOCCOC.[Cl-]
InChIInChI=1S/C10H24NO2.ClH/c1-5-11(3,6-2)7-8-13-10-9-12-4;/h5-10H2,1-4H3;1H/q+1;/p-1
InChIKeyAWXPPLUKWOIBRY-UHFFFAOYSA-M
XLogP-1.86
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.76
LogP ≤ 5-1.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

diethyl-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-methylazanium
CID 90306950
diethyl-(2-methoxyethyl)-methylazanium iodide
CID 71374868
bis[2-(2-methoxyethoxy)ethyl]-dimethylazanium chloride
CID 129073269
diethyl-(2-methoxyethyl)-methylazanium;3-(2-ethoxyethoxy)propanoate
CID 118645363
triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate
CID 87737614
2-(2-methoxyethoxy)ethyl-(2-methoxyethyl)-dimethylazanium iodide
CID 167445578
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87439194
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189
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
diethyl-(2-methoxyethyl)-methylazanium;ethyl carbonate
CID 167445572
triethyl-[3-[2-(2-methoxyethoxy)ethoxy]propyl]azanium
CID 135364479
tris[2-(2-methoxyethoxy)ethyl]-propylazanium;trihydrobromide
CID 173388150

Frequently Asked Questions

What is the IUPAC name of diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride?
The IUPAC name of diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride (CID 167445594) is diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride.
What is the SMILES notation for diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride?
The canonical SMILES for diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride is CC[N+](C)(CC)CCOCCOC.[Cl-].
What is the InChIKey of diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride?
The InChIKey is AWXPPLUKWOIBRY-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H24NO2.ClH/c1-5-11(3,6-2)7-8-13-10-9-12-4;/h5-10H2,1-4H3;1H/q+1;/p-1.
What are the key properties of diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride?
diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride has a molecular weight of 225.76 g/mol, XLogP of -1.86, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride is sourced from PubChem (CID 167445594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).