methane;5-methoxyhexyl(trimethyl)azanium

C11H28NO+ — CID 158505301

IUPACmethane;5-methoxyhexyl(trimethyl)azanium
SMILESC.COC(C)CCCC[N+](C)(C)C
InChIInChI=1S/C10H24NO.CH4/c1-10(12-5)8-6-7-9-11(2,3)4;/h10H,6-9H2,1-5H3;1H4/q+1;
InChIKeyHKJXCGYBYNHTIS-UHFFFAOYSA-N
MW190.35 g/mol
LogP2.53
Rot. Bonds6

About methane;5-methoxyhexyl(trimethyl)azanium

methane;5-methoxyhexyl(trimethyl)azanium (PubChem CID 158505301) has the molecular formula C11H28NO+ and a molecular weight of 190.35 g/mol. Its IUPAC name is methane;5-methoxyhexyl(trimethyl)azanium.

Molecular Properties

Compound Namemethane;5-methoxyhexyl(trimethyl)azanium
PubChem CID158505301
Molecular FormulaC11H28NO+
Molecular Weight190.35 g/mol
Exact Mass190.22
IUPAC Namemethane;5-methoxyhexyl(trimethyl)azanium
SMILESC.COC(C)CCCC[N+](C)(C)C
InChIInChI=1S/C10H24NO.CH4/c1-10(12-5)8-6-7-9-11(2,3)4;/h10H,6-9H2,1-5H3;1H4/q+1;
InChIKeyHKJXCGYBYNHTIS-UHFFFAOYSA-N
XLogP2.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.35
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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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Frequently Asked Questions

What is the IUPAC name of methane;5-methoxyhexyl(trimethyl)azanium?
The IUPAC name of methane;5-methoxyhexyl(trimethyl)azanium (CID 158505301) is methane;5-methoxyhexyl(trimethyl)azanium.
What is the SMILES notation for methane;5-methoxyhexyl(trimethyl)azanium?
The canonical SMILES for methane;5-methoxyhexyl(trimethyl)azanium is C.COC(C)CCCC[N+](C)(C)C.
What is the InChIKey of methane;5-methoxyhexyl(trimethyl)azanium?
The InChIKey is HKJXCGYBYNHTIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24NO.CH4/c1-10(12-5)8-6-7-9-11(2,3)4;/h10H,6-9H2,1-5H3;1H4/q+1;.
What are the key properties of methane;5-methoxyhexyl(trimethyl)azanium?
methane;5-methoxyhexyl(trimethyl)azanium has a molecular weight of 190.35 g/mol, XLogP of 2.53, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;5-methoxyhexyl(trimethyl)azanium is sourced from PubChem (CID 158505301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).