2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione

C10H10N2O7 — CID 66890451

IUPAC2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione
SMILESO=C(O)CN1C(=O)C=CC1=O.O=C1CCC(=O)N1O
InChIInChI=1S/C6H5NO4.C4H5NO3/c8-4-1-2-5(9)7(4)3-6(10)11;6-3-1-2-4(7)5(3)8/h1-2H,3H2,(H,10,11);8H,1-2H2
InChIKeyPUEWREFAXIQYDS-UHFFFAOYSA-N
MW270.20 g/mol
LogP-1.48
Rot. Bonds2

About 2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione

2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione (PubChem CID 66890451) has the molecular formula C10H10N2O7 and a molecular weight of 270.20 g/mol. Its IUPAC name is 2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione.

Molecular Properties

Compound Name2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione
PubChem CID66890451
Molecular FormulaC10H10N2O7
Molecular Weight270.20 g/mol
Exact Mass270.05
IUPAC Name2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione
SMILESO=C(O)CN1C(=O)C=CC1=O.O=C1CCC(=O)N1O
InChIInChI=1S/C6H5NO4.C4H5NO3/c8-4-1-2-5(9)7(4)3-6(10)11;6-3-1-2-4(7)5(3)8/h1-2H,3H2,(H,10,11);8H,1-2H2
InChIKeyPUEWREFAXIQYDS-UHFFFAOYSA-N
XLogP-1.48
TPSA132.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.20
LogP ≤ 5-1.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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 2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione?
The IUPAC name of 2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione (CID 66890451) is 2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione.
What is the SMILES notation for 2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione?
The canonical SMILES for 2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione is O=C(O)CN1C(=O)C=CC1=O.O=C1CCC(=O)N1O.
What is the InChIKey of 2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione?
The InChIKey is PUEWREFAXIQYDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5NO4.C4H5NO3/c8-4-1-2-5(9)7(4)3-6(10)11;6-3-1-2-4(7)5(3)8/h1-2H,3H2,(H,10,11);8H,1-2H2.
What are the key properties of 2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione?
2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione has a molecular weight of 270.20 g/mol, XLogP of -1.48, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxopyrrol-1-yl)acetic acid;1-hydroxypyrrolidine-2,5-dione is sourced from PubChem (CID 66890451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).