tert-butyl 3-(pyridin-4-yl)-2H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxylate
Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCc2[nH]nc(-c3ccncc3)c2C1- InChIKey
SMZGESVPFSLEBL-UHFFFAOYSA-N- Molecular formula
- C16H20N4O2
- Average molar mass
- 300.36 g/mol
Names & identifiers
- Preferred name
- tert-butyl 3-(pyridin-4-yl)-2H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxylate
- IUPAC
- tert-butyl 3-pyridin-4-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylate
Names & synonyms
tert-butyl 3-(pyridin-4-yl)-2H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxylate1366053-12-4SCHEMBL10211781SMZGESVPFSLEBL-UHFFFAOYSA-NEN300-784368tert-butyl 3-(pyridin-4-yl)-6,7-dihydro-1H-pyrazolo[4,3-c]pyridine-5(4H)-carboxylate
Database identifiers
- PubChem CID
- 68065985
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 403
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Related reactions
2 records
Compound notes
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