spiro[3H-indene-2,3'-piperidine]-1,2'-dione

C13H13NO2 — CID 121207629

IUPACspiro[3H-indene-2,3'-piperidine]-1,2'-dione
SMILESO=C1NCCCC12Cc1ccccc1C2=O
InChIInChI=1S/C13H13NO2/c15-11-10-5-2-1-4-9(10)8-13(11)6-3-7-14-12(13)16/h1-2,4-5H,3,6-8H2,(H,14,16)
InChIKeyZQTCVBUECAUNAD-UHFFFAOYSA-N
MW215.25 g/mol
LogP1.32
Rot. Bonds

About spiro[3H-indene-2,3'-piperidine]-1,2'-dione

spiro[3H-indene-2,3'-piperidine]-1,2'-dione (PubChem CID 121207629) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is spiro[3H-indene-2,3'-piperidine]-1,2'-dione.

Molecular Properties

Compound Namespiro[3H-indene-2,3'-piperidine]-1,2'-dione
PubChem CID121207629
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Namespiro[3H-indene-2,3'-piperidine]-1,2'-dione
SMILESO=C1NCCCC12Cc1ccccc1C2=O
InChIInChI=1S/C13H13NO2/c15-11-10-5-2-1-4-9(10)8-13(11)6-3-7-14-12(13)16/h1-2,4-5H,3,6-8H2,(H,14,16)
InChIKeyZQTCVBUECAUNAD-UHFFFAOYSA-N
XLogP1.32
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of spiro[3H-indene-2,3'-piperidine]-1,2'-dione?
The IUPAC name of spiro[3H-indene-2,3'-piperidine]-1,2'-dione (CID 121207629) is spiro[3H-indene-2,3'-piperidine]-1,2'-dione.
What is the SMILES notation for spiro[3H-indene-2,3'-piperidine]-1,2'-dione?
The canonical SMILES for spiro[3H-indene-2,3'-piperidine]-1,2'-dione is O=C1NCCCC12Cc1ccccc1C2=O.
What is the InChIKey of spiro[3H-indene-2,3'-piperidine]-1,2'-dione?
The InChIKey is ZQTCVBUECAUNAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c15-11-10-5-2-1-4-9(10)8-13(11)6-3-7-14-12(13)16/h1-2,4-5H,3,6-8H2,(H,14,16).
What are the key properties of spiro[3H-indene-2,3'-piperidine]-1,2'-dione?
spiro[3H-indene-2,3'-piperidine]-1,2'-dione has a molecular weight of 215.25 g/mol, XLogP of 1.32, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[3H-indene-2,3'-piperidine]-1,2'-dione is sourced from PubChem (CID 121207629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).