Structure Info
- Chemspace ID
- CSMB00010499231 (Enamine MADE)
- MFCD
- MFCD22689330
- IUPAC Name
- 4-methyl-2-oxo-6-(propan-2-yl)-1,2-dihydropyridine-3-carbonitrile
- Mol formula
- C10H12N2O
- Mol weight
- 176 Da
- Catalog Number(s)
- 3560AJ, 69R0938, A029183400, AG141235, ArZ-UP129618, BBV-45306478, BD283361, CD11349139, CSC010499231, D702204, FCH1867608, LN02176594, ZXC098741
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.16
- Heavy atoms count
- 13
- Rotatable bond count
- 1
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.4
- Polar surface area (Å)
- 53
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00010499231
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