dimethyl 1-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5,6-dicarboxylate
Basic information
- Standard SMILES
COC(=O)c1cc2c(nc1C(=O)OC)N(C)CC2- InChIKey
SBVVQEWBEFNJCG-UHFFFAOYSA-N- Molecular formula
- C12H14N2O4
- Average molar mass
- 250.25 g/mol
Names & identifiers
- Preferred name
- dimethyl 1-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5,6-dicarboxylate
- IUPAC
- dimethyl 1-methyl-2,3-dihydropyrrolo[2,3-b]pyridine-5,6-dicarboxylate
Names & synonyms
SCHEMBL8832199SBVVQEWBEFNJCG-UHFFFAOYSA-Ndimethyl 1-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5,6-dicarboxylatedimethyl 1-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5,6-dica rboxylate
Database identifiers
- PubChem CID
- 19958232
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 68.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 347
Related reactions
14 records
Compound notes
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