1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione

C9H11N3O6 — CID 153336194

IUPAC1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione
SMILESCON1C(=O)C=CC1=O.NON1C(=O)CCC1=O
InChIInChI=1S/C5H5NO3.C4H6N2O3/c1-9-6-4(7)2-3-5(6)8;5-9-6-3(7)1-2-4(6)8/h2-3H,1H3;1-2,5H2
InChIKeyNXVYPCVBCJFXEP-UHFFFAOYSA-N
MW257.20 g/mol
LogP-1.59
Rot. Bonds2

About 1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione

1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione (PubChem CID 153336194) has the molecular formula C9H11N3O6 and a molecular weight of 257.20 g/mol. Its IUPAC name is 1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione.

Molecular Properties

Compound Name1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione
PubChem CID153336194
Molecular FormulaC9H11N3O6
Molecular Weight257.20 g/mol
Exact Mass257.06
IUPAC Name1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione
SMILESCON1C(=O)C=CC1=O.NON1C(=O)CCC1=O
InChIInChI=1S/C5H5NO3.C4H6N2O3/c1-9-6-4(7)2-3-5(6)8;5-9-6-3(7)1-2-4(6)8/h2-3H,1H3;1-2,5H2
InChIKeyNXVYPCVBCJFXEP-UHFFFAOYSA-N
XLogP-1.59
TPSA119.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.20
LogP ≤ 5-1.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

1-Hydroxypyrrolidine-2,5-dione;pyrrole-2,5-dione
CID 19989411
2,5-Dioxopyrrolidin-1-yl 2,5-dioxo-2,5-dihydro-1H-pyrrole-1-carboxylate
CID 22389997
Pyrrole-2,5-dione;pyrrolidine-2,5-dione
CID 67242374
Azane;pyrrole-2,5-dione;pyrrolidine-2,5-dione
CID 69713789
(2,5-Dioxopyrrolidin-1-yl) acetate;pyrrole-2,5-dione
CID 87683063
(2,5-Dioxopyrrolidin-1-yl) propanoate;pyrrole-2,5-dione
CID 118571190
1-[(2,5-Dioxopyrrolidin-1-yl)oxymethyl]pyrrole-2,5-dione
CID 126595986
1-(2,5-Dioxopyrrolidin-1-yl)oxypyrrole-2,5-dione
CID 126595994
(2,5-Dioxopyrrolidin-1-yl) (2,5-dioxopyrrol-1-yl) carbonate
CID 134308868
(2,5-Dioxopyrrolidin-1-yl) butanoate;pyrrole-2,5-dione
CID 139513214
1-(Oxomethoxy)pyrrolidine-2,5-dione;pyrrol-1-ide-2,5-dione;tris(yttrium)
CID 140728791
1-(Oxomethoxy)pyrrolidine-2,5-dione;pyrrol-1-ide-2,5-dione;yttrium
CID 144791109

Frequently Asked Questions

What is the IUPAC name of 1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione?
The IUPAC name of 1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione (CID 153336194) is 1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione.
What is the SMILES notation for 1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione?
The canonical SMILES for 1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione is CON1C(=O)C=CC1=O.NON1C(=O)CCC1=O.
What is the InChIKey of 1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione?
The InChIKey is NXVYPCVBCJFXEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5NO3.C4H6N2O3/c1-9-6-4(7)2-3-5(6)8;5-9-6-3(7)1-2-4(6)8/h2-3H,1H3;1-2,5H2.
What are the key properties of 1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione?
1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione has a molecular weight of 257.20 g/mol, XLogP of -1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminooxypyrrolidine-2,5-dione;1-methoxypyrrole-2,5-dione is sourced from PubChem (CID 153336194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).