tetrapropylazanium hydroxide

C12H29NO — CID 20586

IUPACtetrapropylazanium hydroxide
SMILESCCC[N+](CCC)(CCC)CCC.[OH-]
InChIInChI=1S/C12H28N.H2O/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-12H2,1-4H3;1H2/q+1;/p-1
InChIKeyLPSKDVINWQNWFE-UHFFFAOYSA-M
MW203.37 g/mol
LogP3.27
Rot. Bonds8

About tetrapropylazanium hydroxide

tetrapropylazanium hydroxide (PubChem CID 20586) has the molecular formula C12H29NO and a molecular weight of 203.37 g/mol. Its IUPAC name is tetrapropylazanium hydroxide.

Molecular Properties

Compound Nametetrapropylazanium hydroxide
PubChem CID20586
Molecular FormulaC12H29NO
Molecular Weight203.37 g/mol
Exact Mass203.22
IUPAC Nametetrapropylazanium hydroxide
SMILESCCC[N+](CCC)(CCC)CCC.[OH-]
InChIInChI=1S/C12H28N.H2O/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-12H2,1-4H3;1H2/q+1;/p-1
InChIKeyLPSKDVINWQNWFE-UHFFFAOYSA-M
XLogP3.27
TPSA30.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.37
LogP ≤ 53.27
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

Tributylamine
CID 7622
Tripropylamine
CID 7616
Tetrabutylammonium Hydroxide
CID 2723671
Tetraethylammonium Hydroxide
CID 6509
Tetrapropylammonium iodide
CID 12429
N-Methyldibutylamine
CID 18855
Tetrapropylammonium bromide
CID 74745
Tetrapropylammonium
CID 9559
Diethylbutylamine
CID 20513
Di-n-butylethylamine
CID 78207
Tetrapropylammonium chloride
CID 79880
Tributylmethylammonium hydroxide
CID 36208

Frequently Asked Questions

What is the IUPAC name of tetrapropylazanium hydroxide?
The IUPAC name of tetrapropylazanium hydroxide (CID 20586) is tetrapropylazanium hydroxide.
What is the SMILES notation for tetrapropylazanium hydroxide?
The canonical SMILES for tetrapropylazanium hydroxide is CCC[N+](CCC)(CCC)CCC.[OH-].
What is the InChIKey of tetrapropylazanium hydroxide?
The InChIKey is LPSKDVINWQNWFE-UHFFFAOYSA-M. The full InChI is InChI=1S/C12H28N.H2O/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-12H2,1-4H3;1H2/q+1;/p-1.
What are the key properties of tetrapropylazanium hydroxide?
tetrapropylazanium hydroxide has a molecular weight of 203.37 g/mol, XLogP of 3.27, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tetrapropylazanium hydroxide is sourced from PubChem (CID 20586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).