Structure Info
- Chemspace ID
- CSMB00020826764 (Enamine MADE)
- IUPAC Name
- 5-amino-3-(2-cyanoethyl)-1-methyl-1H-pyrazole-4-carbonitrile
- Mol formula
- C8H9N5
- Mol weight
- 175 Da
- Catalog Number(s)
- BBV-94979722, CSC020826764, FCH6078929
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.47
- Heavy atoms count
- 13
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.375
- Polar surface area (Å)
- 91
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00020826764
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