Basic information
- Standard SMILES
Nc1nc2c([nH]1)c(=O)n(C1CC1)c(=O)n2C1CC1- InChIKey
ONLIBHWZVVTZQO-UHFFFAOYSA-N- Molecular formula
- C11H13N5O2
- Average molar mass
- 247.25 g/mol
Names & identifiers
- Preferred name
- 1,3-Di-cyclopropyl-8-amino Xanthine
- IUPAC
- 8-amino-1,3-dicyclopropyl-7H-purine-2,6-dione
Names & synonyms
SCHEMBL7031837ONLIBHWZVVTZQO-UHFFFAOYSA-N1,3-Di-cyclopropyl-8-amino Xanthine
Database identifiers
- PubChem CID
- 9813621
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 95.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 420
Related reactions
5 records
Compound notes
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