Basic information
- Standard SMILES
CC(=O)Nc1cc(Nc2cc(NC3CC3)n3ncc(C#N)c3n2)ncc1C- InChIKey
JSFKRGALSAXHRE-UHFFFAOYSA-N- Molecular formula
- C18H18N8O
- Average molar mass
- 362.4 g/mol
Names & identifiers
- Preferred name
- N-[2-[[3-cyano-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-5-methyl-4-pyridinyl]acetamide
- IUPAC
- N-[2-[[3-cyano-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-5-methyl-4-pyridinyl]acetamide
Names & synonyms
CHEMBL2409180
Database identifiers
- PubChem CID
- 72163929
- ChEMBL
CHEMBL2409180
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 601
Related reactions
1 records
Linked notes
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