9-[2-(1-Ethylpiperidin-4-yl)ethyl]-8-methoxy-2-pentan-2-yloxypurin-6-amine
Basic information
- Standard SMILES
CCCC(C)Oc1nc(N)c2nc(OC)n(CCC3CCN(CC)CC3)c2n1- InChIKey
YAIDCCFDXPAZHF-UHFFFAOYSA-N- Molecular formula
- C20H34N6O2
- Average molar mass
- 390.5 g/mol
- Monoisotopic mass
- 390.27432435
Names & identifiers
- Preferred name
- 9-[2-(1-Ethylpiperidin-4-yl)ethyl]-8-methoxy-2-pentan-2-yloxypurin-6-amine
- IUPAC
- 9-[2-(1-ethylpiperidin-4-yl)ethyl]-8-methoxy-2-pentan-2-yloxypurin-6-amine
Database identifiers
- PubChem CID
- 76754657
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 91.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 462
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Related reactions
1 records
Compound notes
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