3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one

C7H11N2O6P — CID 535756

IUPAC3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one
SMILESCOP(=O)(N1CCOC1=O)N1CCOC1=O
InChIInChI=1S/C7H11N2O6P/c1-13-16(12,8-2-4-14-6(8)10)9-3-5-15-7(9)11/h2-5H2,1H3
InChIKeyKHMLHIYAFBBJAZ-UHFFFAOYSA-N
MW250.15 g/mol
LogP0.65
Rot. Bonds3

About 3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one

3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one (PubChem CID 535756) has the molecular formula C7H11N2O6P and a molecular weight of 250.15 g/mol. Its IUPAC name is 3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one
PubChem CID535756
Molecular FormulaC7H11N2O6P
Molecular Weight250.15 g/mol
Exact Mass250.04
IUPAC Name3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one
SMILESCOP(=O)(N1CCOC1=O)N1CCOC1=O
InChIInChI=1S/C7H11N2O6P/c1-13-16(12,8-2-4-14-6(8)10)9-3-5-15-7(9)11/h2-5H2,1H3
InChIKeyKHMLHIYAFBBJAZ-UHFFFAOYSA-N
XLogP0.65
TPSA85.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.15
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one (CID 535756) is 3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one is COP(=O)(N1CCOC1=O)N1CCOC1=O.
What is the InChIKey of 3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one?
The InChIKey is KHMLHIYAFBBJAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N2O6P/c1-13-16(12,8-2-4-14-6(8)10)9-3-5-15-7(9)11/h2-5H2,1H3.
What are the key properties of 3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one?
3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one has a molecular weight of 250.15 g/mol, XLogP of 0.65, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methoxy-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 535756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).