1-hydroxy-3-phenoxypyrrolidine-2,5-dione

C10H9NO4 — CID 149252640

IUPAC1-hydroxy-3-phenoxypyrrolidine-2,5-dione
SMILESO=C1CC(Oc2ccccc2)C(=O)N1O
InChIInChI=1S/C10H9NO4/c12-9-6-8(10(13)11(9)14)15-7-4-2-1-3-5-7/h1-5,8,14H,6H2
InChIKeyRRZPSOOJUGRKCL-UHFFFAOYSA-N
MW207.19 g/mol
LogP0.58
Rot. Bonds2

About 1-hydroxy-3-phenoxypyrrolidine-2,5-dione

1-hydroxy-3-phenoxypyrrolidine-2,5-dione (PubChem CID 149252640) has the molecular formula C10H9NO4 and a molecular weight of 207.19 g/mol. Its IUPAC name is 1-hydroxy-3-phenoxypyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-hydroxy-3-phenoxypyrrolidine-2,5-dione
PubChem CID149252640
Molecular FormulaC10H9NO4
Molecular Weight207.19 g/mol
Exact Mass207.05
IUPAC Name1-hydroxy-3-phenoxypyrrolidine-2,5-dione
SMILESO=C1CC(Oc2ccccc2)C(=O)N1O
InChIInChI=1S/C10H9NO4/c12-9-6-8(10(13)11(9)14)15-7-4-2-1-3-5-7/h1-5,8,14H,6H2
InChIKeyRRZPSOOJUGRKCL-UHFFFAOYSA-N
XLogP0.58
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.19
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-3-phenoxypyrrolidine-2,5-dione?
The IUPAC name of 1-hydroxy-3-phenoxypyrrolidine-2,5-dione (CID 149252640) is 1-hydroxy-3-phenoxypyrrolidine-2,5-dione.
What is the SMILES notation for 1-hydroxy-3-phenoxypyrrolidine-2,5-dione?
The canonical SMILES for 1-hydroxy-3-phenoxypyrrolidine-2,5-dione is O=C1CC(Oc2ccccc2)C(=O)N1O.
What is the InChIKey of 1-hydroxy-3-phenoxypyrrolidine-2,5-dione?
The InChIKey is RRZPSOOJUGRKCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO4/c12-9-6-8(10(13)11(9)14)15-7-4-2-1-3-5-7/h1-5,8,14H,6H2.
What are the key properties of 1-hydroxy-3-phenoxypyrrolidine-2,5-dione?
1-hydroxy-3-phenoxypyrrolidine-2,5-dione has a molecular weight of 207.19 g/mol, XLogP of 0.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-3-phenoxypyrrolidine-2,5-dione is sourced from PubChem (CID 149252640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).