4-ethylhexyl(dimethyl)azanium

C10H24N+ — CID 171800943

IUPAC4-ethylhexyl(dimethyl)azanium
SMILESCCC(CC)CCC[NH+](C)C
InChIInChI=1S/C10H23N/c1-5-10(6-2)8-7-9-11(3)4/h10H,5-9H2,1-4H3/p+1
InChIKeyULHXWMDHZFEUJY-UHFFFAOYSA-O
MW158.31 g/mol
LogP1.35
Rot. Bonds6

About 4-ethylhexyl(dimethyl)azanium

4-ethylhexyl(dimethyl)azanium (PubChem CID 171800943) has the molecular formula C10H24N+ and a molecular weight of 158.31 g/mol. Its IUPAC name is 4-ethylhexyl(dimethyl)azanium.

Molecular Properties

Compound Name4-ethylhexyl(dimethyl)azanium
PubChem CID171800943
Molecular FormulaC10H24N+
Molecular Weight158.31 g/mol
Exact Mass158.19
IUPAC Name4-ethylhexyl(dimethyl)azanium
SMILESCCC(CC)CCC[NH+](C)C
InChIInChI=1S/C10H23N/c1-5-10(6-2)8-7-9-11(3)4/h10H,5-9H2,1-4H3/p+1
InChIKeyULHXWMDHZFEUJY-UHFFFAOYSA-O
XLogP1.35
TPSA4.44 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.31
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

3,7-diethylnonane
CID 22089120
3,6-diethyloctane
CID 526424
3-ethyloctane;propane
CID 143682929
3-ethylicosane
CID 528487
3-ethylpentacosane
CID 22224239
5-ethylheptane-1-thiol
CID 141457634
ethane;3-ethylundecane
CID 144815521
3-ethyl-7-methylnonane
CID 526426
3,6-diethylundecane
CID 22051817
3-ethyl-8-methyldecane
CID 57490930
5-ethylheptylphosphane
CID 90926602
N,7-diethylnonan-3-amine
CID 82925508

Frequently Asked Questions

What is the IUPAC name of 4-ethylhexyl(dimethyl)azanium?
The IUPAC name of 4-ethylhexyl(dimethyl)azanium (CID 171800943) is 4-ethylhexyl(dimethyl)azanium.
What is the SMILES notation for 4-ethylhexyl(dimethyl)azanium?
The canonical SMILES for 4-ethylhexyl(dimethyl)azanium is CCC(CC)CCC[NH+](C)C.
What is the InChIKey of 4-ethylhexyl(dimethyl)azanium?
The InChIKey is ULHXWMDHZFEUJY-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H23N/c1-5-10(6-2)8-7-9-11(3)4/h10H,5-9H2,1-4H3/p+1.
What are the key properties of 4-ethylhexyl(dimethyl)azanium?
4-ethylhexyl(dimethyl)azanium has a molecular weight of 158.31 g/mol, XLogP of 1.35, 6 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylhexyl(dimethyl)azanium is sourced from PubChem (CID 171800943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).