6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione

C8H8N2O2 — CID 596283

IUPAC6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione
SMILESCc1cc2c(c(=O)[nH]1)C(=O)NC2
InChIInChI=1S/C8H8N2O2/c1-4-2-5-3-9-7(11)6(5)8(12)10-4/h2H,3H2,1H3,(H,9,11)(H,10,12)
InChIKeyQKHQTKXYVUEONP-UHFFFAOYSA-N
MW164.16 g/mol
LogP-0.07
Rot. Bonds

About 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione

6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione (PubChem CID 596283) has the molecular formula C8H8N2O2 and a molecular weight of 164.16 g/mol. Its IUPAC name is 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione.

Molecular Properties

Compound Name6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione
PubChem CID596283
Molecular FormulaC8H8N2O2
Molecular Weight164.16 g/mol
Exact Mass164.06
IUPAC Name6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione
SMILESCc1cc2c(c(=O)[nH]1)C(=O)NC2
InChIInChI=1S/C8H8N2O2/c1-4-2-5-3-9-7(11)6(5)8(12)10-4/h2H,3H2,1H3,(H,9,11)(H,10,12)
InChIKeyQKHQTKXYVUEONP-UHFFFAOYSA-N
XLogP-0.07
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-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 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione?
The IUPAC name of 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione (CID 596283) is 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione.
What is the SMILES notation for 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione?
The canonical SMILES for 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione is Cc1cc2c(c(=O)[nH]1)C(=O)NC2.
What is the InChIKey of 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione?
The InChIKey is QKHQTKXYVUEONP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2/c1-4-2-5-3-9-7(11)6(5)8(12)10-4/h2H,3H2,1H3,(H,9,11)(H,10,12).
What are the key properties of 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione?
6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione has a molecular weight of 164.16 g/mol, XLogP of -0.07, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione is sourced from PubChem (CID 596283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).