3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one

C8H6F2N2O2 — CID 118956075

IUPAC3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1cc(F)cc(F)n1
InChIInChI=1S/C8H6F2N2O2/c9-5-3-6(10)11-7(4-5)12-1-2-14-8(12)13/h3-4H,1-2H2
InChIKeyQYDXKRBIXHNWNA-UHFFFAOYSA-N
MW200.14 g/mol
LogP1.32
Rot. Bonds1

About 3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one

3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one (PubChem CID 118956075) has the molecular formula C8H6F2N2O2 and a molecular weight of 200.14 g/mol. Its IUPAC name is 3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one
PubChem CID118956075
Molecular FormulaC8H6F2N2O2
Molecular Weight200.14 g/mol
Exact Mass200.04
IUPAC Name3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1cc(F)cc(F)n1
InChIInChI=1S/C8H6F2N2O2/c9-5-3-6(10)11-7(4-5)12-1-2-14-8(12)13/h3-4H,1-2H2
InChIKeyQYDXKRBIXHNWNA-UHFFFAOYSA-N
XLogP1.32
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.14
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

3-(2-chloro-6-methylpyrimidin-4-yl)-1,3-oxazolidin-2-one
CID 130285167
3-[6-(1-hydroxyethyl)-4-methyl-2-pyridinyl]-1,3-oxazolidin-2-one
CID 176710420
4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one
CID 166768562
3-(2-chloro-5-fluoropyrimidin-4-yl)-1,3-oxazolidin-2-one
CID 86730264
3-[6-(1-hydroxyethyl)-4-methyl-2-pyridinyl]-1,3-oxazolidin-2-one;toluene
CID 176710419
3-[2-(aminomethyl)-4-fluorophenyl]-1,3-oxazolidin-2-one
CID 82015368
3-(3-bromo-4-fluorophenyl)-1,3-oxazolidin-2-one
CID 104779667
3-[2-(aminomethyl)-5-fluorophenyl]-1,3-oxazolidin-2-one;hydrochloride
CID 21069848
4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)benzaldehyde
CID 87670002
3-[6-(propylsulfanylamino)-2-pyridinyl]-1,3-oxazolidin-2-one
CID 155111241
3-[4-(2-amino-1,3-oxazol-4-yl)-3-fluorophenyl]-1,3-oxazolidin-2-one
CID 18980579
ethane;2-methylpropane;3-[5-(trifluoromethyl)-2-pyridinyl]-1,3-oxazolidin-2-one
CID 143049847

Frequently Asked Questions

What is the IUPAC name of 3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one (CID 118956075) is 3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one is O=C1OCCN1c1cc(F)cc(F)n1.
What is the InChIKey of 3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one?
The InChIKey is QYDXKRBIXHNWNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F2N2O2/c9-5-3-6(10)11-7(4-5)12-1-2-14-8(12)13/h3-4H,1-2H2.
What are the key properties of 3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one?
3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one has a molecular weight of 200.14 g/mol, XLogP of 1.32, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,6-difluoro-2-pyridinyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 118956075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).