ethene;bis(pyrrole-2,5-dione)

C10H10N2O4 — CID 158772678

IUPACethene;bis(pyrrole-2,5-dione)
SMILESC=C.O=C1C=CC(=O)N1.O=C1C=CC(=O)N1
InChIInChI=1S/2C4H3NO2.C2H4/c2*6-3-1-2-4(7)5-3;1-2/h2*1-2H,(H,5,6,7);1-2H2
InChIKeyIQBLYMCFIBYFFT-UHFFFAOYSA-N
MW222.20 g/mol
LogP-0.80
Rot. Bonds

About ethene;bis(pyrrole-2,5-dione)

ethene;bis(pyrrole-2,5-dione) (PubChem CID 158772678) has the molecular formula C10H10N2O4 and a molecular weight of 222.20 g/mol. Its IUPAC name is ethene;bis(pyrrole-2,5-dione).

Molecular Properties

Compound Nameethene;bis(pyrrole-2,5-dione)
PubChem CID158772678
Molecular FormulaC10H10N2O4
Molecular Weight222.20 g/mol
Exact Mass222.06
IUPAC Nameethene;bis(pyrrole-2,5-dione)
SMILESC=C.O=C1C=CC(=O)N1.O=C1C=CC(=O)N1
InChIInChI=1S/2C4H3NO2.C2H4/c2*6-3-1-2-4(7)5-3;1-2/h2*1-2H,(H,5,6,7);1-2H2
InChIKeyIQBLYMCFIBYFFT-UHFFFAOYSA-N
XLogP-0.80
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.20
LogP ≤ 5-0.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze ethene;bis(pyrrole-2,5-dione) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethene;bis(pyrrole-2,5-dione)?
The IUPAC name of ethene;bis(pyrrole-2,5-dione) (CID 158772678) is ethene;bis(pyrrole-2,5-dione).
What is the SMILES notation for ethene;bis(pyrrole-2,5-dione)?
The canonical SMILES for ethene;bis(pyrrole-2,5-dione) is C=C.O=C1C=CC(=O)N1.O=C1C=CC(=O)N1.
What is the InChIKey of ethene;bis(pyrrole-2,5-dione)?
The InChIKey is IQBLYMCFIBYFFT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H3NO2.C2H4/c2*6-3-1-2-4(7)5-3;1-2/h2*1-2H,(H,5,6,7);1-2H2.
What are the key properties of ethene;bis(pyrrole-2,5-dione)?
ethene;bis(pyrrole-2,5-dione) has a molecular weight of 222.20 g/mol, XLogP of -0.80, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;bis(pyrrole-2,5-dione) is sourced from PubChem (CID 158772678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).