hydron;phosphorososilane;tetrabutylazanium

C16H40NOPSi+2 — CID 174875707

IUPAChydron;phosphorososilane;tetrabutylazanium
SMILESCCCC[N+](CCCC)(CCCC)CCCC.O=P[SiH3].[H+]
InChIInChI=1S/C16H36N.H3OPSi/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-2-3/h5-16H2,1-4H3;3H3/q+1;/p+1
InChIKeyNYQQYGUERWOIAK-UHFFFAOYSA-O
MW321.56 g/mol
LogP4.67
Rot. Bonds12

About hydron;phosphorososilane;tetrabutylazanium

hydron;phosphorososilane;tetrabutylazanium (PubChem CID 174875707) has the molecular formula C16H40NOPSi+2 and a molecular weight of 321.56 g/mol. Its IUPAC name is hydron;phosphorososilane;tetrabutylazanium.

Molecular Properties

Compound Namehydron;phosphorososilane;tetrabutylazanium
PubChem CID174875707
Molecular FormulaC16H40NOPSi+2
Molecular Weight321.56 g/mol
Exact Mass321.26
IUPAC Namehydron;phosphorososilane;tetrabutylazanium
SMILESCCCC[N+](CCCC)(CCCC)CCCC.O=P[SiH3].[H+]
InChIInChI=1S/C16H36N.H3OPSi/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-2-3/h5-16H2,1-4H3;3H3/q+1;/p+1
InChIKeyNYQQYGUERWOIAK-UHFFFAOYSA-O
XLogP4.67
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.56
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

hydron;oxophosphane;tetrabutylazanium
CID 174884742
hydron;tetrabutylazanium;diiodide
CID 173281455
hydron;tetrabutylazanium;sulfide
CID 87064104
hydron;tetrabutylazanium;hydrobromide
CID 173127393
tetrabutylazanium;pentahydrate
CID 173386676
tetrabutylazanium hydroxide
CID 2723671
butyl(tripentyl)azanium
CID 14022644
dodecane;tetrabutylazanium
CID 173225937
tributyl(triacontyl)azanium
CID 153322884
tributyl(hexadecyl)azanium
CID 3083031
tetrabutylazanium;fluoride;dihydrate
CID 22343550
bis(palladium(2+));bis(tetrabutylazanium);hexachloride
CID 51000427

Frequently Asked Questions

What is the IUPAC name of hydron;phosphorososilane;tetrabutylazanium?
The IUPAC name of hydron;phosphorososilane;tetrabutylazanium (CID 174875707) is hydron;phosphorososilane;tetrabutylazanium.
What is the SMILES notation for hydron;phosphorososilane;tetrabutylazanium?
The canonical SMILES for hydron;phosphorososilane;tetrabutylazanium is CCCC[N+](CCCC)(CCCC)CCCC.O=P[SiH3].[H+].
What is the InChIKey of hydron;phosphorososilane;tetrabutylazanium?
The InChIKey is NYQQYGUERWOIAK-UHFFFAOYSA-O. The full InChI is InChI=1S/C16H36N.H3OPSi/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-2-3/h5-16H2,1-4H3;3H3/q+1;/p+1.
What are the key properties of hydron;phosphorososilane;tetrabutylazanium?
hydron;phosphorososilane;tetrabutylazanium has a molecular weight of 321.56 g/mol, XLogP of 4.67, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;phosphorososilane;tetrabutylazanium is sourced from PubChem (CID 174875707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).