Basic information
- Standard SMILES
COC(=O)c1cc2cc(OCc3ccccc3)cnc2[nH]1- InChIKey
HLYORDYFLAPNHW-UHFFFAOYSA-N- Molecular formula
- C16H14N2O3
- Average molar mass
- 282.29 g/mol
Names & identifiers
- Preferred name
- 5-Benzyloxy-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester
- IUPAC
- methyl 5-phenylmethoxy-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
Names & synonyms
SCHEMBL2872790HLYORDYFLAPNHW-UHFFFAOYSA-N5-Benzyloxy-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester
Database identifiers
- PubChem CID
- 68423477
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 64.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 357
Related reactions
3 records
Compound notes
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