n,n-Bis(2-ethoxyethyl)-1h-pyrazolo[3,4-d]pyrimidin-4-amine
Basic information
- CAS
6312-65-8- Standard SMILES
CCOCCN(CCOCC)c1ncnc2[nH]ncc12- InChIKey
OCONWPSTXIFKPM-UHFFFAOYSA-N- Molecular formula
- C13H21N5O2
- Average molar mass
- 279.34 g/mol
- Monoisotopic mass
- 279.16952493
Names & identifiers
- Preferred name
- n,n-Bis(2-ethoxyethyl)-1h-pyrazolo[3,4-d]pyrimidin-4-amine
- IUPAC
- N,N-bis(2-ethoxyethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine
Names & synonyms
6312-65-8n,n-bis(2-ethoxyethyl)-1h-pyrazolo[3,4-d]pyrimidin-4-amineNSC40381DTXSID90285061OCONWPSTXIFKPM-UHFFFAOYSA-NNSC-40381
Database identifiers
- CAS
6312-65-8- PubChem CID
- 237117
- DTXSID
DTXSID90285061
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 76.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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