didecyl(dimethyl)azanium hydroxide

C22H49NO — CID 11595363

IUPACdidecyl(dimethyl)azanium hydroxide
SMILESCCCCCCCCCC[N+](C)(C)CCCCCCCCCC.[OH-]
InChIInChI=1S/C22H48N.H2O/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H2/q+1;/p-1
InChIKeyFAEUZVNNXJDELC-UHFFFAOYSA-M
MW343.64 g/mol
LogP7.17
Rot. Bonds18

About didecyl(dimethyl)azanium hydroxide

didecyl(dimethyl)azanium hydroxide (PubChem CID 11595363) has the molecular formula C22H49NO and a molecular weight of 343.64 g/mol. Its IUPAC name is didecyl(dimethyl)azanium hydroxide.

Molecular Properties

Compound Namedidecyl(dimethyl)azanium hydroxide
PubChem CID11595363
Molecular FormulaC22H49NO
Molecular Weight343.64 g/mol
Exact Mass343.38
IUPAC Namedidecyl(dimethyl)azanium hydroxide
SMILESCCCCCCCCCC[N+](C)(C)CCCCCCCCCC.[OH-]
InChIInChI=1S/C22H48N.H2O/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H2/q+1;/p-1
InChIKeyFAEUZVNNXJDELC-UHFFFAOYSA-M
XLogP7.17
TPSA30.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds18
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.64
LogP ≤ 57.17
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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Related Compounds

dodecyl-dimethyl-undecylazanium
CID 21491028
icosyl-[6-[icosyl(dimethyl)azaniumyl]hexyl]-dimethylazanium
CID 154725315
heptyl-dimethyl-undecylazanium
CID 122480849
decyl-dimethyl-tetradecylazanium
CID 13075680
decyl-hexadecyl-dimethylazanium
CID 102585787
dimethyl-octadecyl-tricosylazanium
CID 158669819
decyl-[4-[decyl(dimethyl)azaniumyl]butyl]-dimethylazanium
CID 12958280
decyl-[12-[decyl(dimethyl)azaniumyl]dodecyl]-dimethylazanium
CID 12958288
decyl-heptadecyl-dimethylazanium
CID 22158969
decyl-[5-[decyl(dimethyl)azaniumyl]pentyl]-dimethylazanium
CID 12958282
dimethyl-pentyl-tridecylazanium
CID 160884159
6-[dimethyl(nonadecyl)azaniumyl]hexyl-dimethyl-nonadecylazanium
CID 154726413

Frequently Asked Questions

What is the IUPAC name of didecyl(dimethyl)azanium hydroxide?
The IUPAC name of didecyl(dimethyl)azanium hydroxide (CID 11595363) is didecyl(dimethyl)azanium hydroxide.
What is the SMILES notation for didecyl(dimethyl)azanium hydroxide?
The canonical SMILES for didecyl(dimethyl)azanium hydroxide is CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.[OH-].
What is the InChIKey of didecyl(dimethyl)azanium hydroxide?
The InChIKey is FAEUZVNNXJDELC-UHFFFAOYSA-M. The full InChI is InChI=1S/C22H48N.H2O/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H2/q+1;/p-1.
What are the key properties of didecyl(dimethyl)azanium hydroxide?
didecyl(dimethyl)azanium hydroxide has a molecular weight of 343.64 g/mol, XLogP of 7.17, 18 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for didecyl(dimethyl)azanium hydroxide is sourced from PubChem (CID 11595363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).