Basic information
- CAS
5417-85-6- Standard SMILES
CCNc1nc(NCC)c2cn[nH]c2n1- InChIKey
UFBCYFATXXBOMD-UHFFFAOYSA-N- Molecular formula
- C9H14N6
- Average molar mass
- 206.25 g/mol
- Monoisotopic mass
- 206.12799447
Names & identifiers
- Preferred name
- 4-N,6-N-diethyl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine
- IUPAC
- 4-N,6-N-diethyl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine
Names & synonyms
5417-85-6NSC11599DTXSID60969124NSC-11599N~4~,N~6~-Diethyl-1H-pyrazolo[3,4-d]pyrimidine-4,6(2H,5H)-diimine
Database identifiers
- CAS
5417-85-6- PubChem CID
- 223702
- DTXSID
DTXSID60969124
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 199
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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