5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one

C12H14N2O2 — CID 15043286

IUPAC5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one
SMILESCOc1ccc2c(c1)C1(CCNC1)C(=O)N2
InChIInChI=1S/C12H14N2O2/c1-16-8-2-3-10-9(6-8)12(11(15)14-10)4-5-13-7-12/h2-3,6,13H,4-5,7H2,1H3,(H,14,15)
InChIKeyQUFRJMCKEIYCGV-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.88
Rot. Bonds1

About 5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one

5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one (PubChem CID 15043286) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one.

Molecular Properties

Compound Name5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one
PubChem CID15043286
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one
SMILESCOc1ccc2c(c1)C1(CCNC1)C(=O)N2
InChIInChI=1S/C12H14N2O2/c1-16-8-2-3-10-9(6-8)12(11(15)14-10)4-5-13-7-12/h2-3,6,13H,4-5,7H2,1H3,(H,14,15)
InChIKeyQUFRJMCKEIYCGV-UHFFFAOYSA-N
XLogP0.88
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one?
The IUPAC name of 5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one (CID 15043286) is 5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one.
What is the SMILES notation for 5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one?
The canonical SMILES for 5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one is COc1ccc2c(c1)C1(CCNC1)C(=O)N2.
What is the InChIKey of 5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one?
The InChIKey is QUFRJMCKEIYCGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-16-8-2-3-10-9(6-8)12(11(15)14-10)4-5-13-7-12/h2-3,6,13H,4-5,7H2,1H3,(H,14,15).
What are the key properties of 5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one?
5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one has a molecular weight of 218.26 g/mol, XLogP of 0.88, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxyspiro[1H-indole-3,3'-pyrrolidine]-2-one is sourced from PubChem (CID 15043286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).