Structure Info
- Chemspace ID
- CSMB00009863494 (Enamine MADE)
- MFCD
- MFCD14706235
- IUPAC Name
- 5-amino-1-methyl-3-(2-methylpropyl)-1H-pyrazole-4-carbonitrile
- Mol formula
- C9H14N4
- Mol weight
- 178 Da
- Catalog Number(s)
- 96812, 96812-0.25G, A049004222, BBV-39749570, BD00948049, CSC009863494, FCH1161676, LN04802194, Y4121501
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.08
- Heavy atoms count
- 13
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.555
- Polar surface area (Å)
- 68
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00009863494
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