Basic information
- Standard SMILES
CCc1nc2c(cnn2CC)c(NC2CCOCC2)c1CN=[N+]=[N-]- InChIKey
QMRQBPBDPDTQBI-UHFFFAOYSA-N- Molecular formula
- C16H23N7O
- Average molar mass
- 329.4 g/mol
Names & identifiers
- Preferred name
- 5-(Azidomethyl)-1,6-diethyl-N-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-b]pyridin-4-amine
- IUPAC
- 5-(azidomethyl)-1,6-diethyl-N-(oxan-4-yl)pyrazolo[3,4-b]pyridin-4-amine
Names & synonyms
SCHEMBL13602109QMRQBPBDPDTQBI-UHFFFAOYSA-N5-(Azidomethyl)-1,6-diethyl-N-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-b]pyridin-4-amine
Database identifiers
- PubChem CID
- 59683232
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 66.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 450
Related reactions
13 records
Compound notes
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