Structure Info
- Chemspace ID
- CSMB00011917002 (Enamine MADE)
- CAS
- 1341641-27-7
- MFCD
- MFCD18878942
- IUPAC Name
- 1,3-dimethyl-5-[(propan-2-yl)amino]-1H-pyrazole-4-carbonitrile
- Mol formula
- C9H14N4
- Mol weight
- 178 Da
- Catalog Number(s)
- BBV-37843811, BD01007582, CS-0305211, CSC011917002, EN300-1153723, HY-W261802
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.72
- Heavy atoms count
- 13
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.555
- Polar surface area (Å)
- 54
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00011917002
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