Basic information
- CAS
86818-75-9- Standard SMILES
CN1C(=O)C2CC(=O)N(Cc3ccccc3)C(=O)C2C1=O- InChIKey
WJVJWKWNMFUIGX-UHFFFAOYSA-N- Molecular formula
- C15H14N2O4
- Average molar mass
- 286.28 g/mol
- Monoisotopic mass
- 286.09535693
Names & identifiers
- Preferred name
- 5-Benzyl-2-methyldihydro-1H-pyrrolo[3,4-c]pyridine-1,3,4,6(2H,3aH,5H)-tetrone
- IUPAC
- 5-benzyl-2-methyl-7,7a-dihydro-3aH-pyrrolo[3,4-c]pyridine-1,3,4,6-tetrone
Names & synonyms
86818-75-9NSC3357835-Benzyl-2-methyldihydro-1H-pyrrolo[3,4-c]pyridine-1,3,4,6(2H,3aH,5H)-tetrone5-Benzyl-2-methyldihydro-1H-pyrrolo[3,4-c]pyridine-1,3,4,6(2H,3aH,5H)-tetraone5-Benzyl-2-methyldihydro-1H-pyrrolo(3,4-c)pyridine-1,3,4,6(2H,3aH,5H)-tetroneNSC 335783DTXSID8010071145-benzyl-2-methyl-7,7a-dihydro-3aH-pyrrolo[3,4-c]pyridine-1,3,4,6-tetroneNSC-335783DS-008928
Database identifiers
- CAS
86818-75-9- PubChem CID
- 333573
- DTXSID
DTXSID801007114
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 510
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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