Structure Info
- Chemspace ID
- CSMB00012745620 (Enamine MADE)
- CAS
- 1536877-36-7
- MFCD
- MFCD23894234
- IUPAC Name
- 5-amino-3-methyl-1-(propan-2-yl)-1H-pyrazole-4-carbonitrile
- Mol formula
- C8H12N4
- Mol weight
- 164 Da
- Catalog Number(s)
- BBV-42946362, BD01004340, CSC012745620, EN300-1617941
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.42
- Heavy atoms count
- 12
- Rotatable bond count
- 1
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 68
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00012745620
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