4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine

C10H21FNO3P — CID 22895108

IUPAC4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine
SMILESCC1(C)CC(OP(C)(=O)F)CC(C)(C)N1O
InChIInChI=1S/C10H21FNO3P/c1-9(2)6-8(15-16(5,11)14)7-10(3,4)12(9)13/h8,13H,6-7H2,1-5H3
InChIKeyNUXNONQXJRPPSN-UHFFFAOYSA-N
MW253.25 g/mol
LogP3.21
Rot. Bonds2

About 4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine

4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine (PubChem CID 22895108) has the molecular formula C10H21FNO3P and a molecular weight of 253.25 g/mol. Its IUPAC name is 4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine.

Molecular Properties

Compound Name4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine
PubChem CID22895108
Molecular FormulaC10H21FNO3P
Molecular Weight253.25 g/mol
Exact Mass253.12
IUPAC Name4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine
SMILESCC1(C)CC(OP(C)(=O)F)CC(C)(C)N1O
InChIInChI=1S/C10H21FNO3P/c1-9(2)6-8(15-16(5,11)14)7-10(3,4)12(9)13/h8,13H,6-7H2,1-5H3
InChIKeyNUXNONQXJRPPSN-UHFFFAOYSA-N
XLogP3.21
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.25
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(Ethoxyfluorophosphinyloxy)-TEMPO
CID 71310009
4-[(Ethoxyflorophosphinyl)oxy]-2,2,6,6,-tetramethyl-1-piperidine-1-oxyl
CID 5207310
1-Hydroxy-4-phosphono-oxy-2,2,6,6-tetramethyl-piperidine
CID 4550871
1-(Dimethoxyphosphorylmethoxy)-2,2,6,6-tetramethylpiperidin-4-ol
CID 59510539
1-Methoxy-2,2,6,6-tetramethyl piperidin-4-yl methyl phosphate
CID 71297215
4-[Fluoro(methyl)phosphoryl]oxy-2,2,6,6-tetramethylpiperidine
CID 22895100
1-Oxyl-2,2,6,6-tetramethyl-4-piperidinyl methylphosphonofluoridate
CID 59968778
Ethoxy-fluoro-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyphosphane
CID 87313561
4-[Fluoro(methyl)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium
CID 101587196
4-[Fluoro(propoxy)phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium
CID 101587201
4-Dichlorophosphoryloxy-1-hydroxy-2,2,6,6-tetramethylpiperidine
CID 429278
4-Phosphonooxy-tempo hydrate
CID 16211714

Frequently Asked Questions

What is the IUPAC name of 4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine?
The IUPAC name of 4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine (CID 22895108) is 4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine.
What is the SMILES notation for 4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine?
The canonical SMILES for 4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine is CC1(C)CC(OP(C)(=O)F)CC(C)(C)N1O.
What is the InChIKey of 4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine?
The InChIKey is NUXNONQXJRPPSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21FNO3P/c1-9(2)6-8(15-16(5,11)14)7-10(3,4)12(9)13/h8,13H,6-7H2,1-5H3.
What are the key properties of 4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine?
4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine has a molecular weight of 253.25 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[fluoro(methyl)phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine is sourced from PubChem (CID 22895108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).