Basic information
- Standard SMILES
CC(C)N1CCC(Nc2nc3cncnc3n2Cc2ccc(F)cc2)CC1- InChIKey
UIFJVEUYRSLGPV-UHFFFAOYSA-N- Molecular formula
- C20H25FN6
- Average molar mass
- 368.5 g/mol
Names & identifiers
- Preferred name
- 9-[(4-fluorophenyl)methyl]-N-[1-(1-methylethyl)-4-piperidinyl]-9H-purin-8-amine
- IUPAC
- 9-[(4-fluorophenyl)methyl]-N-(1-propan-2-ylpiperidin-4-yl)purin-8-amine
Names & synonyms
SCHEMBL9564812UIFJVEUYRSLGPV-UHFFFAOYSA-N9-[(4-fluorophenyl)methyl]-N-[1-(1-methylethyl)-4-piperidinyl]-9H-purin-8-amine
Database identifiers
- PubChem CID
- 19785308
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 461
Related reactions
3 records
Compound notes
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