Structure Info
- Chemspace ID
- CSMB02461903720 (Enamine MADE)
- IUPAC Name
- methyl 3-{[(2-cyanoethyl)amino]methyl}oxetane-3-carboxylate
- Mol formula
- C9H14N2O3
- Mol weight
- 198 Da
- Catalog Number(s)
- BBV-934704160, Z4014743181, m_273610_16950226_11515974, m_273610____16950226____11515974
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.86
- Heavy atoms count
- 14
- Rotatable bond count
- 6
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.777
- Polar surface area (Å)
- 71
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB02461903720
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