2-methoxyethyl(trimethyl)azanium chloride

C6H16ClNO — CID 23352174

IUPAC2-methoxyethyl(trimethyl)azanium chloride
SMILESCOCC[N+](C)(C)C.[Cl-]
InChIInChI=1S/C6H16NO.ClH/c1-7(2,3)5-6-8-4;/h5-6H2,1-4H3;1H/q+1;/p-1
InChIKeyMSIGGUSMCUUDGY-UHFFFAOYSA-M
MW153.65 g/mol
LogP-2.66
Rot. Bonds3

About 2-methoxyethyl(trimethyl)azanium chloride

2-methoxyethyl(trimethyl)azanium chloride (PubChem CID 23352174) has the molecular formula C6H16ClNO and a molecular weight of 153.65 g/mol. Its IUPAC name is 2-methoxyethyl(trimethyl)azanium chloride.

Molecular Properties

Compound Name2-methoxyethyl(trimethyl)azanium chloride
PubChem CID23352174
Molecular FormulaC6H16ClNO
Molecular Weight153.65 g/mol
Exact Mass153.09
IUPAC Name2-methoxyethyl(trimethyl)azanium chloride
SMILESCOCC[N+](C)(C)C.[Cl-]
InChIInChI=1S/C6H16NO.ClH/c1-7(2,3)5-6-8-4;/h5-6H2,1-4H3;1H/q+1;/p-1
InChIKeyMSIGGUSMCUUDGY-UHFFFAOYSA-M
XLogP-2.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.65
LogP ≤ 5-2.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-methoxyethyl(trimethyl)azanium tetrafluoroborate
CID 87222095
2-methoxyethyl(trimethyl)azanium;1-methoxypropane;2-methoxypropane
CID 160720515
methane;3-methoxypropyl(trimethyl)azanium
CID 159181056
3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]propanoate;2-methoxyethyl(trimethyl)azanium
CID 118645294
2-[methoxy(2-methoxyethoxy)phosphoryl]oxyethyl-trimethylazanium
CID 174291074
disodium;2-(trimethylazaniumyl)ethyl phosphate;chloride
CID 171699407
diethyl-(2-methoxyethyl)-methylazanium iodide
CID 71374868
fluoromethyl-(2-methoxyethyl)-dimethylazanium iodide
CID 146629304
2-methoxyethyl-dimethyl-propan-2-ylazanium
CID 123576136
2-hydroperoxyethyl(trimethyl)azanium;sulfane
CID 174916235
trimethyl-[2-[2-[2-(trimethylazaniumyl)ethoxy]ethoxy]ethyl]azanium;hydrochloride
CID 174841287
trimethyl(2-phosphonooxyethyl)azanium;chloride;hydrochloride
CID 87786144

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethyl(trimethyl)azanium chloride?
The IUPAC name of 2-methoxyethyl(trimethyl)azanium chloride (CID 23352174) is 2-methoxyethyl(trimethyl)azanium chloride.
What is the SMILES notation for 2-methoxyethyl(trimethyl)azanium chloride?
The canonical SMILES for 2-methoxyethyl(trimethyl)azanium chloride is COCC[N+](C)(C)C.[Cl-].
What is the InChIKey of 2-methoxyethyl(trimethyl)azanium chloride?
The InChIKey is MSIGGUSMCUUDGY-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H16NO.ClH/c1-7(2,3)5-6-8-4;/h5-6H2,1-4H3;1H/q+1;/p-1.
What are the key properties of 2-methoxyethyl(trimethyl)azanium chloride?
2-methoxyethyl(trimethyl)azanium chloride has a molecular weight of 153.65 g/mol, XLogP of -2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethyl(trimethyl)azanium chloride is sourced from PubChem (CID 23352174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).