Basic information
- Standard SMILES
CN(C(=O)OC(C)(C)C)[C@@H]1CCN(c2cnnc(NC34CC5CC(CC(C5)C3)C4)c2)C1- InChIKey
GMSZBOFFOVYEBS-LAHWMRIESA-N- Molecular formula
- C24H37N5O2
- Average molar mass
- 427.6 g/mol
Names & identifiers
- Preferred name
- (R)-tert-butyl methyl(1-(6-(1-adamantylamino)pyridazin-4-yl)pyrrolidin-3-yl)carbamate
- IUPAC
- tert-butyl N-[(3R)-1-[6-(1-adamantylamino)pyridazin-4-yl]pyrrolidin-3-yl]-N-methylcarbamate
Names & synonyms
SCHEMBL1589310GMSZBOFFOVYEBS-LAHWMRIESA-N(R)-tert-butyl methyl(1-(6-(1-adamantylamino)pyridazin-4-yl)pyrrolidin-3-yl)carbamate
Database identifiers
- PubChem CID
- 67087696
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 636
Related reactions
2 records
Linked notes
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