Basic information
- CAS
121252-55-9- Standard SMILES
Cn1cnc2c(NC34CCC(CC3)C4)ncnc21- InChIKey
NCQNNYOJKKOGAY-UHFFFAOYSA-N- Molecular formula
- C13H17N5
- Average molar mass
- 243.31 g/mol
- Monoisotopic mass
- 243.14839556
Names & identifiers
- Preferred name
- N-(4-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amine
- IUPAC
- N-(1-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amine
Names & synonyms
N-(4-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amineDTXSID80275658121252-55-9N-(Bicyclo[2.2.1]heptan-1-yl)-9-methyl-9H-purin-6-amine
Database identifiers
- CAS
121252-55-9- PubChem CID
- 60735
- DTXSID
DTXSID80275658
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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