2-hydroxyethyl(nonyl)azanium iodide

C11H26INO — CID 175684966

IUPAC2-hydroxyethyl(nonyl)azanium iodide
SMILESCCCCCCCCC[NH2+]CCO.[I-]
InChIInChI=1S/C11H25NO.HI/c1-2-3-4-5-6-7-8-9-12-10-11-13;/h12-13H,2-11H2,1H3;1H
InChIKeyLEVMWOSACOMWLJ-UHFFFAOYSA-N
MW315.24 g/mol
LogP-1.70
Rot. Bonds10

About 2-hydroxyethyl(nonyl)azanium iodide

2-hydroxyethyl(nonyl)azanium iodide (PubChem CID 175684966) has the molecular formula C11H26INO and a molecular weight of 315.24 g/mol. Its IUPAC name is 2-hydroxyethyl(nonyl)azanium iodide.

Molecular Properties

Compound Name2-hydroxyethyl(nonyl)azanium iodide
PubChem CID175684966
Molecular FormulaC11H26INO
Molecular Weight315.24 g/mol
Exact Mass315.11
IUPAC Name2-hydroxyethyl(nonyl)azanium iodide
SMILESCCCCCCCCC[NH2+]CCO.[I-]
InChIInChI=1S/C11H25NO.HI/c1-2-3-4-5-6-7-8-9-12-10-11-13;/h12-13H,2-11H2,1H3;1H
InChIKeyLEVMWOSACOMWLJ-UHFFFAOYSA-N
XLogP-1.70
TPSA36.84 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.24
LogP ≤ 5-1.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

didodecylazanium fluoride
CID 87135434
butyl(dodecyl)azanium
CID 91941247
butyl(tetradecyl)azanium chloride
CID 20788665
azanium;dioctadecylazanium;dichloride
CID 172767895
ethyl(tridecyl)azanium iodide
CID 88651524
bis(2-hydroxyethyl)azanium;decanoate
CID 87299732
dioctadecylazanium tetrafluoroborate
CID 140565722
decane;propan-1-ol
CID 157421705
bis(2-hydroxyethyl)azanium;hexadecyl sulfate
CID 53447388
magnesium;hexan-1-ol;iodide
CID 173010286
decyl-[6-(decylazaniumyl)hexyl]-dimethylazanium
CID 131700914
bis(2-hydroxyethyl)azanium;hexadecyl hydrogen phosphate
CID 164511657

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl(nonyl)azanium iodide?
The IUPAC name of 2-hydroxyethyl(nonyl)azanium iodide (CID 175684966) is 2-hydroxyethyl(nonyl)azanium iodide.
What is the SMILES notation for 2-hydroxyethyl(nonyl)azanium iodide?
The canonical SMILES for 2-hydroxyethyl(nonyl)azanium iodide is CCCCCCCCC[NH2+]CCO.[I-].
What is the InChIKey of 2-hydroxyethyl(nonyl)azanium iodide?
The InChIKey is LEVMWOSACOMWLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO.HI/c1-2-3-4-5-6-7-8-9-12-10-11-13;/h12-13H,2-11H2,1H3;1H.
What are the key properties of 2-hydroxyethyl(nonyl)azanium iodide?
2-hydroxyethyl(nonyl)azanium iodide has a molecular weight of 315.24 g/mol, XLogP of -1.70, 10 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl(nonyl)azanium iodide is sourced from PubChem (CID 175684966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).