7H-Purin-6-amine, 8,9-dihydro-N-(phenylmethyl)-9-(tetrahydro-2H-pyran-2-yl)-
Basic information
- Standard SMILES
c1ccc(CNc2ncnc3c2NCN3C2CCCCO2)cc1- InChIKey
FKRXYPROOUJTLY-UHFFFAOYSA-N- Molecular formula
- C17H21N5O
- Average molar mass
- 311.4 g/mol
- Monoisotopic mass
- 311.17461031
Names & identifiers
- Preferred name
- 7H-Purin-6-amine, 8,9-dihydro-N-(phenylmethyl)-9-(tetrahydro-2H-pyran-2-yl)-
- IUPAC
- N-benzyl-9-(oxan-2-yl)-7,8-dihydropurin-6-amine
Names & synonyms
69152-46-1N-Benzyl-9-(tetrahydro-2H-pyran-2-yl)-8,9-dihydro-7H-purin-6-amineN-benzyl-9-(oxan-2-yl)-8,9-dihydro-7H-purin-6-amine7H-Purin-6-amine, 8,9-dihydro-N-(phenylmethyl)-9-(tetrahydro-2H-pyran-2-yl)-DTXSID6041555
Database identifiers
- PubChem CID
- 155201
- DTXSID
DTXSID6041555
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 62.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 376
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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