2,7-Dimethyl[1,2,4]triazolo[1,5-a]pyridine
Basic information
- CAS
4931-22-0- Standard SMILES
Cc1ccn2nc(C)nc2c1- InChIKey
DJQNDZIDERYZRJ-UHFFFAOYSA-N- Molecular formula
- C8H9N3
- Average molar mass
- 147.18 g/mol
- Monoisotopic mass
- 147.0796473
Names & identifiers
- Preferred name
- 2,7-Dimethyl[1,2,4]triazolo[1,5-a]pyridine
- IUPAC
- 2,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine
- English name
- 2,7-Dimethyl[1,2,4]triazolo[1,5-a]pyridine
- Molecular formula
- C8H9N3
- Molecular weight
- 147.18
Names & synonyms
4931-22-02,7-dimethyl[1,2,4]triazolo[1,5-a]pyridine2,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridineNSC79017NCIOpen2_000719SCHEMBL7920632s-Triazolo[1, 2,7-dimethyl-DTXSID70291908NSC-79017[1,4]Triazolo[1,5-a]pyridine, 2,7-dimethyl-[1,2,4]Triazolo[1,5-a]pyridine, 2,7-dimethyl-
Database identifiers
- CAS
4931-22-0- PubChem CID
- 254584
- DTXSID
DTXSID70291908- Nikkaji
- J103.217H
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 148
Physicochemical properties
- Density
- 1.19 · 1.19±0.1 g/cm3(Predicted)
- pka
- 3.96 · 3.96±0.30(Predicted)
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Compound notes
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