methoxyethene;pyrrolidine-2,5-dione

C7H11NO3 — CID 67913272

IUPACmethoxyethene;pyrrolidine-2,5-dione
SMILESC=COC.O=C1CCC(=O)N1
InChIInChI=1S/C4H5NO2.C3H6O/c6-3-1-2-4(7)5-3;1-3-4-2/h1-2H2,(H,5,6,7);3H,1H2,2H3
InChIKeyMQEFNPAFYPUUBO-UHFFFAOYSA-N
MW157.17 g/mol
LogP0.20
Rot. Bonds1

About methoxyethene;pyrrolidine-2,5-dione

methoxyethene;pyrrolidine-2,5-dione (PubChem CID 67913272) has the molecular formula C7H11NO3 and a molecular weight of 157.17 g/mol. Its IUPAC name is methoxyethene;pyrrolidine-2,5-dione.

Molecular Properties

Compound Namemethoxyethene;pyrrolidine-2,5-dione
PubChem CID67913272
Molecular FormulaC7H11NO3
Molecular Weight157.17 g/mol
Exact Mass157.07
IUPAC Namemethoxyethene;pyrrolidine-2,5-dione
SMILESC=COC.O=C1CCC(=O)N1
InChIInChI=1S/C4H5NO2.C3H6O/c6-3-1-2-4(7)5-3;1-3-4-2/h1-2H2,(H,5,6,7);3H,1H2,2H3
InChIKeyMQEFNPAFYPUUBO-UHFFFAOYSA-N
XLogP0.20
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.17
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methoxyethene;pyrrolidine-2,5-dione?
The IUPAC name of methoxyethene;pyrrolidine-2,5-dione (CID 67913272) is methoxyethene;pyrrolidine-2,5-dione.
What is the SMILES notation for methoxyethene;pyrrolidine-2,5-dione?
The canonical SMILES for methoxyethene;pyrrolidine-2,5-dione is C=COC.O=C1CCC(=O)N1.
What is the InChIKey of methoxyethene;pyrrolidine-2,5-dione?
The InChIKey is MQEFNPAFYPUUBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5NO2.C3H6O/c6-3-1-2-4(7)5-3;1-3-4-2/h1-2H2,(H,5,6,7);3H,1H2,2H3.
What are the key properties of methoxyethene;pyrrolidine-2,5-dione?
methoxyethene;pyrrolidine-2,5-dione has a molecular weight of 157.17 g/mol, XLogP of 0.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxyethene;pyrrolidine-2,5-dione is sourced from PubChem (CID 67913272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).