Basic information
- Standard SMILES
Cc1cc(Nc2cc(N3CCOCC3)nc(N[C@@H](C)c3ccc(F)cn3)n2)n[nH]1- InChIKey
PQJFHLYZLWIEJE-ZDUSSCGKSA-N- Molecular formula
- C19H23FN8O
- Average molar mass
- 398.4 g/mol
Names & identifiers
- Preferred name
- N2-[(1S)-1-(5-Fluoropyridin-2-yl)ethyl]-N4-(5-methyl-1H-pyrazol-3-yl)-6-morpholin-4-ylpyrimidine-2,4-diamine
- IUPAC
- 2-N-[(1S)-1-(5-fluoro-2-pyridinyl)ethyl]-4-N-(5-methyl-1H-pyrazol-3-yl)-6-morpholin-4-ylpyrimidine-2,4-diamine
Names & synonyms
PQJFHLYZLWIEJE-ZDUSSCGKSA-NN2-[(1S)-1-(5-Fluoropyridin-2-yl)ethyl]-N4-(5-methyl-1H-pyrazol-3-yl)-6-morpholin-4-ylpyrimidine-2,4-diamine
Database identifiers
- PubChem CID
- 86624809
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 511
Related reactions
1 records
Compound notes
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