5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione

C11H10FNO4 — CID 13092021

IUPAC5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione
SMILESCOc1c(F)cc(C)cc1C1OC(=O)NC1=O
InChIInChI=1S/C11H10FNO4/c1-5-3-6(8(16-2)7(12)4-5)9-10(14)13-11(15)17-9/h3-4,9H,1-2H3,(H,13,14,15)
InChIKeyHMDURVBLOURAJA-UHFFFAOYSA-N
MW239.20 g/mol
LogP1.45
Rot. Bonds2

About 5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione

5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione (PubChem CID 13092021) has the molecular formula C11H10FNO4 and a molecular weight of 239.20 g/mol. Its IUPAC name is 5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione
PubChem CID13092021
Molecular FormulaC11H10FNO4
Molecular Weight239.20 g/mol
Exact Mass239.06
IUPAC Name5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione
SMILESCOc1c(F)cc(C)cc1C1OC(=O)NC1=O
InChIInChI=1S/C11H10FNO4/c1-5-3-6(8(16-2)7(12)4-5)9-10(14)13-11(15)17-9/h3-4,9H,1-2H3,(H,13,14,15)
InChIKeyHMDURVBLOURAJA-UHFFFAOYSA-N
XLogP1.45
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.20
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione?
The IUPAC name of 5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione (CID 13092021) is 5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione is COc1c(F)cc(C)cc1C1OC(=O)NC1=O.
What is the InChIKey of 5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione?
The InChIKey is HMDURVBLOURAJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO4/c1-5-3-6(8(16-2)7(12)4-5)9-10(14)13-11(15)17-9/h3-4,9H,1-2H3,(H,13,14,15).
What are the key properties of 5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione?
5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione has a molecular weight of 239.20 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 13092021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).