Basic information
- Standard SMILES
CCOC(=O)c1cnc2ccc(CCC#N)cn12- InChIKey
WZJXWUBEZXVNJK-UHFFFAOYSA-N- Molecular formula
- C13H13N3O2
- Average molar mass
- 243.26 g/mol
- Monoisotopic mass
- 243.10077667
Names & identifiers
- Preferred name
- Ethyl 6-(2-cyanoethyl)imidazo[1,2-a]pyridine-3-carboxylate
- IUPAC
- ethyl 6-(2-cyanoethyl)imidazo[1,2-a]pyridine-3-carboxylate
Names & synonyms
ethyl 6-(2-cyanoethyl)imidazo[1,2-a]pyridine-3-carboxylate1426136-18-6SCHEMBL14739275WZJXWUBEZXVNJK-UHFFFAOYSA-NCS-0092333
Database identifiers
- PubChem CID
- 71280906
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 349
Related reactions
5 records
Compound notes
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