Basic information
- Standard SMILES
Cc1cc(C(=O)N[C@@H]2CCNC2)no1- InChIKey
TWBLDSAOAGKUPY-SSDOTTSWSA-N- Molecular formula
- C9H13N3O2
- Average molar mass
- 195.22 g/mol
Names & identifiers
- Preferred name
- 5-methyl-isoxazole-3-carboxylic acid (R)-pyrrolidin-3-ylamide
- IUPAC
- 5-methyl-N-[(3R)-pyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
Names & synonyms
SCHEMBL242814TWBLDSAOAGKUPY-SSDOTTSWSA-NAKOS0175318585-methyl-isoxazole-3-carboxylic acid (R)-pyrrolidin-3-ylamide
Database identifiers
- PubChem CID
- 66630893
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 222
Related reactions
2 records
Compound notes
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