2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium

C10H27NO4PSi+ — CID 46830550

IUPAC2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium
SMILESC[N+](C)(C)CCOP(=O)(O)OCC[Si](C)(C)C
InChIInChI=1S/C10H26NO4PSi/c1-11(2,3)7-8-14-16(12,13)15-9-10-17(4,5)6/h7-10H2,1-6H3/p+1
InChIKeyRCMQIVQSXHMFFV-UHFFFAOYSA-O
MW284.39 g/mol
LogP2.16
Rot. Bonds8

About 2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium

2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium (PubChem CID 46830550) has the molecular formula C10H27NO4PSi+ and a molecular weight of 284.39 g/mol. Its IUPAC name is 2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium.

Molecular Properties

Compound Name2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium
PubChem CID46830550
Molecular FormulaC10H27NO4PSi+
Molecular Weight284.39 g/mol
Exact Mass284.14
IUPAC Name2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium
SMILESC[N+](C)(C)CCOP(=O)(O)OCC[Si](C)(C)C
InChIInChI=1S/C10H26NO4PSi/c1-11(2,3)7-8-14-16(12,13)15-9-10-17(4,5)6/h7-10H2,1-6H3/p+1
InChIKeyRCMQIVQSXHMFFV-UHFFFAOYSA-O
XLogP2.16
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.39
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

bis(2-trimethylsilylethyl) hydrogen phosphate
CID 87816838
2-[hydroxy(phosphonooxy)phosphoryl]oxyethyl-trimethylazanium
CID 13292816
ethane;2-[hydroxy(methoxy)phosphoryl]oxyethyl-trimethylazanium
CID 176693850
2-[hydroxy(4-hydroxybutoxy)phosphoryl]oxyethyl-trimethylazanium
CID 91588858
2-[but-3-ynoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium
CID 175231665
2-[2-[[dimethoxy(methyl)silyl]methylamino]ethoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium
CID 59350055
2-[hydroxy(11-sulfanylundecoxy)phosphoryl]oxyethyl-trimethylazanium
CID 100986698
2-[hydroxy(2-phenoxyethoxy)phosphoryl]oxyethyl-trimethylazanium
CID 10881215
2-[hydroxy-[2-(3-trimethoxysilylpropylamino)ethoxy]phosphoryl]oxyethyl-trimethylazanium
CID 11646761
2-[hydroxy(2-methylprop-1-enoxy)phosphoryl]oxyethyl-trimethylazanium
CID 175214536
2-[hydroxy(2-prop-2-enoxyethoxy)phosphoryl]oxyethyl-trimethylazanium
CID 22568162
trimethyl(2-phosphonooxyethyl)azanium;chloride;hydrochloride
CID 87786144

Frequently Asked Questions

What is the IUPAC name of 2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium?
The IUPAC name of 2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium (CID 46830550) is 2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium.
What is the SMILES notation for 2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium?
The canonical SMILES for 2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium is C[N+](C)(C)CCOP(=O)(O)OCC[Si](C)(C)C.
What is the InChIKey of 2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium?
The InChIKey is RCMQIVQSXHMFFV-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H26NO4PSi/c1-11(2,3)7-8-14-16(12,13)15-9-10-17(4,5)6/h7-10H2,1-6H3/p+1.
What are the key properties of 2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium?
2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium has a molecular weight of 284.39 g/mol, XLogP of 2.16, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[hydroxy(2-trimethylsilylethoxy)phosphoryl]oxyethyl-trimethylazanium is sourced from PubChem (CID 46830550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).