2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one

C2H4NO4P — CID 10678295

IUPAC2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one
SMILESO=C1CNP(=O)(O)O1
InChIInChI=1S/C2H4NO4P/c4-2-1-3-8(5,6)7-2/h1H2,(H2,3,5,6)
InChIKeyXPUNIBOFHUNSKB-UHFFFAOYSA-N
MW137.03 g/mol
LogP-0.77
Rot. Bonds

About 2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one

2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one (PubChem CID 10678295) has the molecular formula C2H4NO4P and a molecular weight of 137.03 g/mol. Its IUPAC name is 2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one.

Molecular Properties

Compound Name2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one
PubChem CID10678295
Molecular FormulaC2H4NO4P
Molecular Weight137.03 g/mol
Exact Mass136.99
IUPAC Name2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one
SMILESO=C1CNP(=O)(O)O1
InChIInChI=1S/C2H4NO4P/c4-2-1-3-8(5,6)7-2/h1H2,(H2,3,5,6)
InChIKeyXPUNIBOFHUNSKB-UHFFFAOYSA-N
XLogP-0.77
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.03
LogP ≤ 5-0.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2,12-dihydroxy-2,12-dioxo-1,7-dioxa-4,10-diaza-2λ5,12λ5-diphosphacyclododecane-6,8-dione
CID 163691066
2-methyl-1,3-oxazolidin-5-one
CID 19595572
aziridin-2-one
CID 158991665
2-hydroxy-1,3,5,2λ5-dioxazaphosphinane 2-oxide
CID 18697532
3-hydroxy-3-oxo-4H-2,3λ5-benzoxaphosphinin-1-one
CID 10198088
1,4-diazepan-6-one
CID 23090352
2,6,10-trihydroxy-1,3,5,7,9,11-hexaoxa-2λ5,6λ5,10λ5-triphosphacyclododecane 2,6,10-trioxide
CID 172770499
1,3-oxazolidin-5-one;sulfane
CID 159369202
1,2,3,4,5,6-hexahydroxy-1λ5,2λ5,3λ5,4λ5,5λ5,6λ5-hexaphosphinane 1,2,3,4,5,6-hexaoxide
CID 71369580
diaziridin-3-one
CID 18008550
2-methyl-1,3,6,2-dioxazaborocane-4,8-dione
CID 143678699
1,4,7,10,13-pentazacyclopentadecane-2,5,8,11,14-pentone
CID 71356739

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one?
The IUPAC name of 2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one (CID 10678295) is 2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one.
What is the SMILES notation for 2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one?
The canonical SMILES for 2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one is O=C1CNP(=O)(O)O1.
What is the InChIKey of 2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one?
The InChIKey is XPUNIBOFHUNSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4NO4P/c4-2-1-3-8(5,6)7-2/h1H2,(H2,3,5,6).
What are the key properties of 2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one?
2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one has a molecular weight of 137.03 g/mol, XLogP of -0.77, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-oxo-1,3,2lambda5-oxazaphospholidin-5-one is sourced from PubChem (CID 10678295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).