5-(furan-3-yl)-1,3-oxazolidine-2,4-dione

C7H5NO4 — CID 12962584

IUPAC5-(furan-3-yl)-1,3-oxazolidine-2,4-dione
SMILESO=C1NC(=O)C(c2ccoc2)O1
InChIInChI=1S/C7H5NO4/c9-6-5(12-7(10)8-6)4-1-2-11-3-4/h1-3,5H,(H,8,9,10)
InChIKeyWHNCQNLFZNRFLR-UHFFFAOYSA-N
MW167.12 g/mol
LogP0.59
Rot. Bonds1

About 5-(furan-3-yl)-1,3-oxazolidine-2,4-dione

5-(furan-3-yl)-1,3-oxazolidine-2,4-dione (PubChem CID 12962584) has the molecular formula C7H5NO4 and a molecular weight of 167.12 g/mol. Its IUPAC name is 5-(furan-3-yl)-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name5-(furan-3-yl)-1,3-oxazolidine-2,4-dione
PubChem CID12962584
Molecular FormulaC7H5NO4
Molecular Weight167.12 g/mol
Exact Mass167.02
IUPAC Name5-(furan-3-yl)-1,3-oxazolidine-2,4-dione
SMILESO=C1NC(=O)C(c2ccoc2)O1
InChIInChI=1S/C7H5NO4/c9-6-5(12-7(10)8-6)4-1-2-11-3-4/h1-3,5H,(H,8,9,10)
InChIKeyWHNCQNLFZNRFLR-UHFFFAOYSA-N
XLogP0.59
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.12
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-3-yl)-1,3-oxazolidine-2,4-dione?
The IUPAC name of 5-(furan-3-yl)-1,3-oxazolidine-2,4-dione (CID 12962584) is 5-(furan-3-yl)-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 5-(furan-3-yl)-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 5-(furan-3-yl)-1,3-oxazolidine-2,4-dione is O=C1NC(=O)C(c2ccoc2)O1.
What is the InChIKey of 5-(furan-3-yl)-1,3-oxazolidine-2,4-dione?
The InChIKey is WHNCQNLFZNRFLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5NO4/c9-6-5(12-7(10)8-6)4-1-2-11-3-4/h1-3,5H,(H,8,9,10).
What are the key properties of 5-(furan-3-yl)-1,3-oxazolidine-2,4-dione?
5-(furan-3-yl)-1,3-oxazolidine-2,4-dione has a molecular weight of 167.12 g/mol, XLogP of 0.59, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-3-yl)-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 12962584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).