spiro[indole-2,2'-pyridine]-3'-one

C12H8N2O — CID 156772231

IUPACspiro[indole-2,2'-pyridine]-3'-one
SMILESO=C1C=CC=NC12C=c1ccccc1=N2
InChIInChI=1S/C12H8N2O/c15-11-6-3-7-13-12(11)8-9-4-1-2-5-10(9)14-12/h1-8H
InChIKeyXWBMXHLPZPMXRH-UHFFFAOYSA-N
MW196.21 g/mol
LogP0.01
Rot. Bonds

About spiro[indole-2,2'-pyridine]-3'-one

spiro[indole-2,2'-pyridine]-3'-one (PubChem CID 156772231) has the molecular formula C12H8N2O and a molecular weight of 196.21 g/mol. Its IUPAC name is spiro[indole-2,2'-pyridine]-3'-one.

Molecular Properties

Compound Namespiro[indole-2,2'-pyridine]-3'-one
PubChem CID156772231
Molecular FormulaC12H8N2O
Molecular Weight196.21 g/mol
Exact Mass196.06
IUPAC Namespiro[indole-2,2'-pyridine]-3'-one
SMILESO=C1C=CC=NC12C=c1ccccc1=N2
InChIInChI=1S/C12H8N2O/c15-11-6-3-7-13-12(11)8-9-4-1-2-5-10(9)14-12/h1-8H
InChIKeyXWBMXHLPZPMXRH-UHFFFAOYSA-N
XLogP0.01
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 50.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of spiro[indole-2,2'-pyridine]-3'-one?
The IUPAC name of spiro[indole-2,2'-pyridine]-3'-one (CID 156772231) is spiro[indole-2,2'-pyridine]-3'-one.
What is the SMILES notation for spiro[indole-2,2'-pyridine]-3'-one?
The canonical SMILES for spiro[indole-2,2'-pyridine]-3'-one is O=C1C=CC=NC12C=c1ccccc1=N2.
What is the InChIKey of spiro[indole-2,2'-pyridine]-3'-one?
The InChIKey is XWBMXHLPZPMXRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2O/c15-11-6-3-7-13-12(11)8-9-4-1-2-5-10(9)14-12/h1-8H.
What are the key properties of spiro[indole-2,2'-pyridine]-3'-one?
spiro[indole-2,2'-pyridine]-3'-one has a molecular weight of 196.21 g/mol, XLogP of 0.01, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[indole-2,2'-pyridine]-3'-one is sourced from PubChem (CID 156772231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).