Structure Info
- Chemspace ID
- CSMB00011917011 (Enamine MADE)
- CAS
- 1339786-81-0
- MFCD
- MFCD18878950
- IUPAC Name
- 5-(ethylamino)-1,3-dimethyl-1H-pyrazole-4-carbonitrile
- Mol formula
- C8H12N4
- Mol weight
- 164 Da
- Catalog Number(s)
- BBV-37843821, BD00955744, CSC011917011, CSCR01064206134, EN300-1153720, PV-002806365105, s_27_61262_4557404, s_27____61262____4557404
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.31
- Heavy atoms count
- 12
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 54
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00011917011
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