spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione

C12H11NO2 — CID 5158225

IUPACspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione
SMILESO=C1CC2(CCc3ccccc32)C(=O)N1
InChIInChI=1S/C12H11NO2/c14-10-7-12(11(15)13-10)6-5-8-3-1-2-4-9(8)12/h1-4H,5-7H2,(H,13,14,15)
InChIKeyGOCQZJLHIGURBI-UHFFFAOYSA-N
MW201.23 g/mol
LogP0.92
Rot. Bonds

About spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione

spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione (PubChem CID 5158225) has the molecular formula C12H11NO2 and a molecular weight of 201.23 g/mol. Its IUPAC name is spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione.

Molecular Properties

Compound Namespiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione
PubChem CID5158225
Molecular FormulaC12H11NO2
Molecular Weight201.23 g/mol
Exact Mass201.08
IUPAC Namespiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione
SMILESO=C1CC2(CCc3ccccc32)C(=O)N1
InChIInChI=1S/C12H11NO2/c14-10-7-12(11(15)13-10)6-5-8-3-1-2-4-9(8)12/h1-4H,5-7H2,(H,13,14,15)
InChIKeyGOCQZJLHIGURBI-UHFFFAOYSA-N
XLogP0.92
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
The IUPAC name of spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione (CID 5158225) is spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione.
What is the SMILES notation for spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
The canonical SMILES for spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione is O=C1CC2(CCc3ccccc32)C(=O)N1.
What is the InChIKey of spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
The InChIKey is GOCQZJLHIGURBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c14-10-7-12(11(15)13-10)6-5-8-3-1-2-4-9(8)12/h1-4H,5-7H2,(H,13,14,15).
What are the key properties of spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione has a molecular weight of 201.23 g/mol, XLogP of 0.92, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione is sourced from PubChem (CID 5158225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).