N-(furan-2-ylmethyl)-9-methylpurin-6-amine
Basic information
- CAS
5401-70-7- Standard SMILES
Cn1cnc2c(NCc3ccco3)ncnc21- InChIKey
RGMVFYIAYDVJCK-UHFFFAOYSA-N- Molecular formula
- C11H11N5O
- Average molar mass
- 229.24 g/mol
- Monoisotopic mass
- 229.09635999
Names & identifiers
- Preferred name
- N-(furan-2-ylmethyl)-9-methylpurin-6-amine
- IUPAC
- N-(furan-2-ylmethyl)-9-methylpurin-6-amine
Names & synonyms
5401-70-7N-(furan-2-ylmethyl)-9-methylpurin-6-amineN-(furan-2-ylmethyl)-9-methyl-9H-purin-6-amineNSC4953n-(2-furylmethyl)-n-(9-methyl-9h-purin-6-yl)amineMLS001048873N-(2-FURYLMETHYL)-9-METHYL-PURIN-6-AMINECHEMBL1327197SCHEMBL20119629DTXSID90277926HMS2268J14NSC-4953
Show more names
STL560621AKOS001715731CCG-121902NCGC00168241-01SMR000387077AB00600956-08AO-343/41780906SR-01000147745
Database identifiers
- CAS
5401-70-7- PubChem CID
- 221107
- DTXSID
DTXSID90277926- ChEMBL
CHEMBL1327197
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 68.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 264
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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