Structure Info
- Chemspace ID
- CSMB00011917017 (Enamine MADE)
- CAS
- 1484466-69-4
- MFCD
- MFCD18878955
- IUPAC Name
- 5-(butylamino)-1,3-dimethyl-1H-pyrazole-4-carbonitrile
- Mol formula
- C10H16N4
- Mol weight
- 192 Da
- Catalog Number(s)
- BBV-37843826, BD00993693, CSC011917017, CSCR01064202330, EN300-1153719, Z1172209122, s_27_61220_4557404, s_27____61220____4557404
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.27
- Heavy atoms count
- 14
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.6
- Polar surface area (Å)
- 54
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00011917017
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