Basic information
- Standard SMILES
Nc1nc2ncnc-2c(-c2ccco2)[nH]1- InChIKey
JZSMPSCWNAYWOI-UHFFFAOYSA-N- Molecular formula
- C9H7N5O
- Average molar mass
- 201.18 g/mol
- Monoisotopic mass
- 201.06505986
Names & identifiers
- Preferred name
- 6-(furan-2-yl)-9H-purin-2-amine
- IUPAC
- 6-(furan-2-yl)-7H-purin-2-amine
Names & synonyms
CHEMBL4044476-(furan-2-yl)-9H-purin-2-amineSCHEMBL3272888SCHEMBL6948083SCHEMBL276917256-(furanyl)-9h-purin-2-amine6-(2-furyl)1H-purine-2-amineJZSMPSCWNAYWOI-UHFFFAOYSA-N6-(2-Furyl)-1H-purine-2-amineBDBM50239041PD182764
Database identifiers
- PubChem CID
- 9834240
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 93.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 239
Related reactions
11 records
Compound notes
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