Basic information
- Standard SMILES
N#CCCCc1ccc2ncc(C(=O)O)n2c1- InChIKey
GIHSGKYULWVBIP-UHFFFAOYSA-N- Molecular formula
- C12H11N3O2
- Average molar mass
- 229.23 g/mol
- Monoisotopic mass
- 229.0851266
Names & identifiers
- Preferred name
- 6-(3-Cyanopropyl)imidazo[1,2-a]pyridine-3-carboxylic acid
- IUPAC
- 6-(3-cyanopropyl)imidazo[1,2-a]pyridine-3-carboxylic acid
Names & synonyms
6-(3-cyanopropyl)imidazo[1,2-a]pyridine-3-carboxylic acid1426135-77-4SCHEMBL14738291GIHSGKYULWVBIP-UHFFFAOYSA-NCS-0092293
Database identifiers
- PubChem CID
- 71280334
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 336
Related reactions
9 records
Compound notes
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