3H-pyrrol-3-ide-2,5-dione;terbium

C4H2NO2Tb- — CID 175760197

IUPAC3H-pyrrol-3-ide-2,5-dione;terbium
SMILESO=C1[C-]=CC(=O)N1.[Tb]
InChIInChI=1S/C4H2NO2.Tb/c6-3-1-2-4(7)5-3;/h1H,(H,5,6,7);/q-1;
InChIKeyMQPCHDUXSFNFNB-UHFFFAOYSA-N
MW254.99 g/mol
LogP-1.00
Rot. Bonds

About 3H-pyrrol-3-ide-2,5-dione;terbium

3H-pyrrol-3-ide-2,5-dione;terbium (PubChem CID 175760197) has the molecular formula C4H2NO2Tb- and a molecular weight of 254.99 g/mol. Its IUPAC name is 3H-pyrrol-3-ide-2,5-dione;terbium.

Molecular Properties

Compound Name3H-pyrrol-3-ide-2,5-dione;terbium
PubChem CID175760197
Molecular FormulaC4H2NO2Tb-
Molecular Weight254.99 g/mol
Exact Mass254.93
IUPAC Name3H-pyrrol-3-ide-2,5-dione;terbium
SMILESO=C1[C-]=CC(=O)N1.[Tb]
InChIInChI=1S/C4H2NO2.Tb/c6-3-1-2-4(7)5-3;/h1H,(H,5,6,7);/q-1;
InChIKeyMQPCHDUXSFNFNB-UHFFFAOYSA-N
XLogP-1.00
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.99
LogP ≤ 5-1.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3H-pyrrol-3-ide-2,5-dione;terbium 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 3H-pyrrol-3-ide-2,5-dione;terbium?
The IUPAC name of 3H-pyrrol-3-ide-2,5-dione;terbium (CID 175760197) is 3H-pyrrol-3-ide-2,5-dione;terbium.
What is the SMILES notation for 3H-pyrrol-3-ide-2,5-dione;terbium?
The canonical SMILES for 3H-pyrrol-3-ide-2,5-dione;terbium is O=C1[C-]=CC(=O)N1.[Tb].
What is the InChIKey of 3H-pyrrol-3-ide-2,5-dione;terbium?
The InChIKey is MQPCHDUXSFNFNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2NO2.Tb/c6-3-1-2-4(7)5-3;/h1H,(H,5,6,7);/q-1;.
What are the key properties of 3H-pyrrol-3-ide-2,5-dione;terbium?
3H-pyrrol-3-ide-2,5-dione;terbium has a molecular weight of 254.99 g/mol, XLogP of -1.00, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3H-pyrrol-3-ide-2,5-dione;terbium is sourced from PubChem (CID 175760197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).