Basic information
- Standard SMILES
CCn1ccc(Nc2cc(Br)cn(C)c2=O)n1- InChIKey
SSORDIKJPZSRKV-UHFFFAOYSA-N- Molecular formula
- C11H13BrN4O
- Average molar mass
- 297.15 g/mol
Names & identifiers
- Preferred name
- 5-Bromo-3-(1-ethyl-1H-pyrazol-3-ylamino)-1-methylpyridin-2(1H)-one
- IUPAC
- 5-bromo-3-[(1-ethylpyrazol-3-yl)amino]-1-methylpyridin-2-one
Names & synonyms
5-Bromo-3-(1-ethyl-1H-pyrazol-3-ylamino)-1-methylpyridin-2(1H)-one1361940-99-9SCHEMBL255552SCHEMBL28379141SSORDIKJPZSRKV-UHFFFAOYSA-NDB-317413
Database identifiers
- PubChem CID
- 66634720
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 380
Related reactions
2 records
Compound notes
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