spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione

C12H12N2O2 — CID 68786443

IUPACspiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione
SMILESO=C1C=CC2(CN1)C(=O)NC1=CC=CCC12
InChIInChI=1S/C12H12N2O2/c15-10-5-6-12(7-13-10)8-3-1-2-4-9(8)14-11(12)16/h1-2,4-6,8H,3,7H2,(H,13,15)(H,14,16)
InChIKeyZMQQVROEAOTEMJ-UHFFFAOYSA-N
MW216.24 g/mol
LogP0.25
Rot. Bonds

About spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione

spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione (PubChem CID 68786443) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione.

Molecular Properties

Compound Namespiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione
PubChem CID68786443
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Namespiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione
SMILESO=C1C=CC2(CN1)C(=O)NC1=CC=CCC12
InChIInChI=1S/C12H12N2O2/c15-10-5-6-12(7-13-10)8-3-1-2-4-9(8)14-11(12)16/h1-2,4-6,8H,3,7H2,(H,13,15)(H,14,16)
InChIKeyZMQQVROEAOTEMJ-UHFFFAOYSA-N
XLogP0.25
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione?
The IUPAC name of spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione (CID 68786443) is spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione.
What is the SMILES notation for spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione?
The canonical SMILES for spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione is O=C1C=CC2(CN1)C(=O)NC1=CC=CCC12.
What is the InChIKey of spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione?
The InChIKey is ZMQQVROEAOTEMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c15-10-5-6-12(7-13-10)8-3-1-2-4-9(8)14-11(12)16/h1-2,4-6,8H,3,7H2,(H,13,15)(H,14,16).
What are the key properties of spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione?
spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione has a molecular weight of 216.24 g/mol, XLogP of 0.25, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,2-dihydropyridine-3,3'-3a,4-dihydro-1H-indole]-2',6-dione is sourced from PubChem (CID 68786443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).