spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione

C11H10N2O2 — CID 170518385

IUPACspiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione
SMILESO=C1NC2(CCNC2=O)c2ccccc21
InChIInChI=1S/C11H10N2O2/c14-9-7-3-1-2-4-8(7)11(13-9)5-6-12-10(11)15/h1-4H,5-6H2,(H,12,15)(H,13,14)
InChIKeyPQARVMNJBQHYAH-UHFFFAOYSA-N
MW202.21 g/mol
LogP0.15
Rot. Bonds

About spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione

spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione (PubChem CID 170518385) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione.

Molecular Properties

Compound Namespiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione
PubChem CID170518385
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Namespiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione
SMILESO=C1NC2(CCNC2=O)c2ccccc21
InChIInChI=1S/C11H10N2O2/c14-9-7-3-1-2-4-8(7)11(13-9)5-6-12-10(11)15/h1-4H,5-6H2,(H,12,15)(H,13,14)
InChIKeyPQARVMNJBQHYAH-UHFFFAOYSA-N
XLogP0.15
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4,4-diphenyl-1,3-diazinan-2-one
CID 23879283
(3R)-3-hydroxy-3-propan-2-yl-2H-isoindol-1-one
CID 124705216
3-tert-butyl-3-deuteriooxy-2H-isoindol-1-one
CID 58979741
2-[3-(1,3-dioxoinden-2-yl)-2-oxopyrrolidin-3-yl]indene-1,3-dione
CID 171573692
spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2'-one
CID 105442633
7-methoxyspiro[2,3-dihydrochromene-4,3'-2H-isoindole]-1'-one
CID 72947320
dimethyl 3-oxo-2H-isoindole-1,1-dicarboxylate
CID 125471809
3-hydroxy-3-prop-2-enyl-2H-isoindol-1-one
CID 14902933
3-cyclohexyl-3-phenyl-2H-isoindol-1-one
CID 134952980
(3R)-3-hydroxy-3-(1H-imidazol-2-yl)-2H-isoindol-1-one
CID 869361
N-[(1R)-3-oxo-1-phenyl-2H-isoindol-1-yl]acetamide
CID 95561425
N,N-dimethyl-3-oxospiro[2H-isoindole-1,4'-piperidine]-1'-carboxamide
CID 97449355

Frequently Asked Questions

What is the IUPAC name of spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione?
The IUPAC name of spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione (CID 170518385) is spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione.
What is the SMILES notation for spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione?
The canonical SMILES for spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione is O=C1NC2(CCNC2=O)c2ccccc21.
What is the InChIKey of spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione?
The InChIKey is PQARVMNJBQHYAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c14-9-7-3-1-2-4-8(7)11(13-9)5-6-12-10(11)15/h1-4H,5-6H2,(H,12,15)(H,13,14).
What are the key properties of spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione?
spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione has a molecular weight of 202.21 g/mol, XLogP of 0.15, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[2H-isoindole-3,3'-pyrrolidine]-1,2'-dione is sourced from PubChem (CID 170518385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).