4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine

C11H22FNO4P- — CID 45039166

IUPAC4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine
SMILESCCOP(=O)(F)OC1CC(C)(C)N([O-])C(C)(C)C1
InChIInChI=1S/C11H22FNO4P/c1-6-16-18(12,15)17-9-7-10(2,3)13(14)11(4,5)8-9/h9H,6-8H2,1-5H3/q-1
InChIKeyPZIKKRYLXYKTAV-UHFFFAOYSA-N
MW282.27 g/mol
LogP3.64
Rot. Bonds4

About 4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine

4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine (PubChem CID 45039166) has the molecular formula C11H22FNO4P- and a molecular weight of 282.27 g/mol. Its IUPAC name is 4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine.

Molecular Properties

Compound Name4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine
PubChem CID45039166
Molecular FormulaC11H22FNO4P-
Molecular Weight282.27 g/mol
Exact Mass282.13
IUPAC Name4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine
SMILESCCOP(=O)(F)OC1CC(C)(C)N([O-])C(C)(C)C1
InChIInChI=1S/C11H22FNO4P/c1-6-16-18(12,15)17-9-7-10(2,3)13(14)11(4,5)8-9/h9H,6-8H2,1-5H3/q-1
InChIKeyPZIKKRYLXYKTAV-UHFFFAOYSA-N
XLogP3.64
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine?
The IUPAC name of 4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine (CID 45039166) is 4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine.
What is the SMILES notation for 4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine?
The canonical SMILES for 4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine is CCOP(=O)(F)OC1CC(C)(C)N([O-])C(C)(C)C1.
What is the InChIKey of 4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine?
The InChIKey is PZIKKRYLXYKTAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22FNO4P/c1-6-16-18(12,15)17-9-7-10(2,3)13(14)11(4,5)8-9/h9H,6-8H2,1-5H3/q-1.
What are the key properties of 4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine?
4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine has a molecular weight of 282.27 g/mol, XLogP of 3.64, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[ethoxy(fluoro)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidine is sourced from PubChem (CID 45039166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).