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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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).