Basic information
- Standard SMILES
CC(C)n1ncc2c1C(=O)NC1(CCN(C(=O)OC(C)(C)C)CC1)C2- InChIKey
SOTIYYYDKMHAIB-UHFFFAOYSA-N- Molecular formula
- C18H28N4O3
- Average molar mass
- 348.4 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 1'-isopropyl-7'-oxo-1',4',6',7'-tetrahydrospiro[piperidine-4,5'-pyrazolo[3,4-c]pyridine]-1-carboxylate
- IUPAC
- tert-butyl 7-oxo-1-propan-2-ylspiro[4,6-dihydropyrazolo[5,4-c]pyridine-5,4'-piperidine]-1'-carboxylate
Names & synonyms
SCHEMBL2671740SOTIYYYDKMHAIB-UHFFFAOYSA-Ntert-butyl 1'-isopropyl-7'-oxo-1',4',6',7'-tetrahydrospiro[piperidine-4,5'-pyrazolo[3,4-c]pyridine]-1-carboxylate
Database identifiers
- PubChem CID
- 67491663
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 76.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 535
Related reactions
3 records
Compound notes
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