N-ethyl-2H-triazolo[4,5-d]pyrimidin-7-amine
Basic information
- CAS
6317-00-6- Standard SMILES
CCNc1ncnc2n[nH]nc12- InChIKey
PEVIHCHBEIZCAG-UHFFFAOYSA-N- Molecular formula
- C6H8N6
- Average molar mass
- 164.17 g/mol
- Monoisotopic mass
- 164.08104428
Names & identifiers
- Preferred name
- N-ethyl-2H-triazolo[4,5-d]pyrimidin-7-amine
- IUPAC
- N-ethyl-2H-triazolo[4,5-d]pyrimidin-7-amine
Names & synonyms
6317-00-6N-ethyl-2H-triazolo[4,5-d]pyrimidin-7-amineNCI60_003825CHEMBL2002128DTXSID50423381NSC40439NSC-40439N-ETHYL-2H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDIN-7-AMINE
Database identifiers
- CAS
6317-00-6- PubChem CID
- 6411289
- DTXSID
DTXSID50423381- ChEMBL
CHEMBL2002128
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 151
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…