6-(3-fluorophenyl)-1,3-oxazine-2,4-dione

C10H6FNO3 — CID 13370936

IUPAC6-(3-fluorophenyl)-1,3-oxazine-2,4-dione
SMILESO=c1cc(-c2cccc(F)c2)oc(=O)[nH]1
InChIInChI=1S/C10H6FNO3/c11-7-3-1-2-6(4-7)8-5-9(13)12-10(14)15-8/h1-5H,(H,12,13,14)
InChIKeyZSOJENFZNIWGNO-UHFFFAOYSA-N
MW207.16 g/mol
LogP1.13
Rot. Bonds1

About 6-(3-fluorophenyl)-1,3-oxazine-2,4-dione

6-(3-fluorophenyl)-1,3-oxazine-2,4-dione (PubChem CID 13370936) has the molecular formula C10H6FNO3 and a molecular weight of 207.16 g/mol. Its IUPAC name is 6-(3-fluorophenyl)-1,3-oxazine-2,4-dione.

Molecular Properties

Compound Name6-(3-fluorophenyl)-1,3-oxazine-2,4-dione
PubChem CID13370936
Molecular FormulaC10H6FNO3
Molecular Weight207.16 g/mol
Exact Mass207.03
IUPAC Name6-(3-fluorophenyl)-1,3-oxazine-2,4-dione
SMILESO=c1cc(-c2cccc(F)c2)oc(=O)[nH]1
InChIInChI=1S/C10H6FNO3/c11-7-3-1-2-6(4-7)8-5-9(13)12-10(14)15-8/h1-5H,(H,12,13,14)
InChIKeyZSOJENFZNIWGNO-UHFFFAOYSA-N
XLogP1.13
TPSA63.07 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.16
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3-fluorophenyl)-1,3-oxazine-2,4-dione?
The IUPAC name of 6-(3-fluorophenyl)-1,3-oxazine-2,4-dione (CID 13370936) is 6-(3-fluorophenyl)-1,3-oxazine-2,4-dione.
What is the SMILES notation for 6-(3-fluorophenyl)-1,3-oxazine-2,4-dione?
The canonical SMILES for 6-(3-fluorophenyl)-1,3-oxazine-2,4-dione is O=c1cc(-c2cccc(F)c2)oc(=O)[nH]1.
What is the InChIKey of 6-(3-fluorophenyl)-1,3-oxazine-2,4-dione?
The InChIKey is ZSOJENFZNIWGNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6FNO3/c11-7-3-1-2-6(4-7)8-5-9(13)12-10(14)15-8/h1-5H,(H,12,13,14).
What are the key properties of 6-(3-fluorophenyl)-1,3-oxazine-2,4-dione?
6-(3-fluorophenyl)-1,3-oxazine-2,4-dione has a molecular weight of 207.16 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluorophenyl)-1,3-oxazine-2,4-dione is sourced from PubChem (CID 13370936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).