Basic information
- CAS
4919-16-8- Standard SMILES
CCCc1nnc2ccccn12- InChIKey
KKGIDDAIVOWMJH-UHFFFAOYSA-N- Molecular formula
- C9H11N3
- Average molar mass
- 161.2 g/mol
- Monoisotopic mass
- 161.09529736
Names & identifiers
- Preferred name
- 3-Propyl[1,2,4]triazolo[4,3-a]pyridine
- IUPAC
- 3-propyl-[1,2,4]triazolo[4,3-a]pyridine
Names & synonyms
3-propyl[1,2,4]triazolo[4,3-a]pyridine3-propyl-[1,2,4]triazolo[4,3-a]pyridine4919-16-8NSC76012NCIOpen2_000898SCHEMBL24862850DTXSID30291505NSC-76012
Database identifiers
- CAS
4919-16-8- PubChem CID
- 253288
- DTXSID
DTXSID30291505- Nikkaji
- J3.607.485J
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…