Basic information
- CAS
89159-34-2- Standard SMILES
Cc1cc2c(c(=O)[nH]1)C(=O)NC2- InChIKey
QKHQTKXYVUEONP-UHFFFAOYSA-N- Molecular formula
- C8H8N2O2
- Average molar mass
- 164.16 g/mol
- Monoisotopic mass
- 164.0585775
Names & identifiers
- Preferred name
- 6-Methyl-1H-pyrrolo[3,4-c]pyridine-3,4(2H,5H)-dione
- IUPAC
- 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione
Names & synonyms
89159-34-26-Methyl-1H-pyrrolo[3,4-c]pyridine-3,4(2H,5H)-dione6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione6-Methyl-1,2-dihydro-3H-pyrrolo[3,4-c]pyridine-3,4(5H)-dioneCBDivE_000702QKHQTKXYVUEONP-UHFFFAOYSA-DTXSID00344370QKHQTKXYVUEONP-UHFFFAOYSA-NSTL566110AKOS001717574AKOS037623693ST4018969
Show more names
6-methyl-5-hydro-3-pyrrolino[3,4-c]pyridine-3,4-dione4-hydroxy-6-methyl-1,2-dihydro-3H-pyrrolo[3,4-c]pyridin-3-oneInChI=1/C8H8N2O2/c1-4-2-5-3-9-7(11)6(5)8(12)10-4/h2H,3H2,1H3,(H,9,11)(H,10,12)
Database identifiers
- CAS
89159-34-2- PubChem CID
- 596283
- DTXSID
DTXSID00344370
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 339
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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