Basic information
- Standard SMILES
COC(=O)C(Cc1ccccc1)NC(=O)c1cccnc1- InChIKey
POVJHVHLYLHTJI-UHFFFAOYSA-N- Molecular formula
- C16H16N2O3
- Average molar mass
- 284.31 g/mol
- Monoisotopic mass
- 284.11609238
Names & identifiers
- Preferred name
- 3-Phenyl-2-[(pyridine-3-carbonyl)-amino]-propionic acid methylester
- IUPAC
- methyl 3-phenyl-2-(pyridine-3-carbonylamino)propanoate
Names & synonyms
SCHEMBL6860349POVJHVHLYLHTJI-UHFFFAOYSA-N3-phenyl-2-[(pyridine-3-carbonyl)-amino]-propionic acid methylester
Database identifiers
- PubChem CID
- 69920002
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 353
Related reactions
1 records
Compound notes
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