3-methylphosphanyloxy-1,3-oxazolidin-2-one

C4H8NO3P — CID 59951361

IUPAC3-methylphosphanyloxy-1,3-oxazolidin-2-one
SMILESCPON1CCOC1=O
InChIInChI=1S/C4H8NO3P/c1-9-8-5-2-3-7-4(5)6/h9H,2-3H2,1H3
InChIKeyPRMYKCVUJUFHFO-UHFFFAOYSA-N
MW149.09 g/mol
LogP0.59
Rot. Bonds2

About 3-methylphosphanyloxy-1,3-oxazolidin-2-one

3-methylphosphanyloxy-1,3-oxazolidin-2-one (PubChem CID 59951361) has the molecular formula C4H8NO3P and a molecular weight of 149.09 g/mol. Its IUPAC name is 3-methylphosphanyloxy-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-methylphosphanyloxy-1,3-oxazolidin-2-one
PubChem CID59951361
Molecular FormulaC4H8NO3P
Molecular Weight149.09 g/mol
Exact Mass149.02
IUPAC Name3-methylphosphanyloxy-1,3-oxazolidin-2-one
SMILESCPON1CCOC1=O
InChIInChI=1S/C4H8NO3P/c1-9-8-5-2-3-7-4(5)6/h9H,2-3H2,1H3
InChIKeyPRMYKCVUJUFHFO-UHFFFAOYSA-N
XLogP0.59
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.09
LogP ≤ 50.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-Methoxy-2-oxazolidone
CID 23110948
Methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid
CID 70480540
3-Ethoxy-1,3-oxazolidin-2-one
CID 150608048
Dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium
CID 174430011
Methyl (2-oxo-1,3-oxazolidin-3-yl) hydrogen phosphite
CID 174430013

Frequently Asked Questions

What is the IUPAC name of 3-methylphosphanyloxy-1,3-oxazolidin-2-one?
The IUPAC name of 3-methylphosphanyloxy-1,3-oxazolidin-2-one (CID 59951361) is 3-methylphosphanyloxy-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-methylphosphanyloxy-1,3-oxazolidin-2-one?
The canonical SMILES for 3-methylphosphanyloxy-1,3-oxazolidin-2-one is CPON1CCOC1=O.
What is the InChIKey of 3-methylphosphanyloxy-1,3-oxazolidin-2-one?
The InChIKey is PRMYKCVUJUFHFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8NO3P/c1-9-8-5-2-3-7-4(5)6/h9H,2-3H2,1H3.
What are the key properties of 3-methylphosphanyloxy-1,3-oxazolidin-2-one?
3-methylphosphanyloxy-1,3-oxazolidin-2-one has a molecular weight of 149.09 g/mol, XLogP of 0.59, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylphosphanyloxy-1,3-oxazolidin-2-one is sourced from PubChem (CID 59951361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).