Basic information
- Standard SMILES
C=CC(=O)NC(CCC(=O)O)C(=O)O- InChIKey
VLEHUIOENHDIKW-UHFFFAOYSA-N- Molecular formula
- C8H11NO5
- Average molar mass
- 201.18 g/mol
Names & identifiers
- Preferred name
- 2-(Prop-2-enoylamino)pentanedioic acid
- IUPAC
- 2-(prop-2-enoylamino)pentanedioic acid
Names & synonyms
SCHEMBL5437088
Database identifiers
- PubChem CID
- 10265239
- Nikkaji
- J1.855.087C
Properties
Computed structural properties
- XLogP
- -1.2
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 260
Related reactions
1 records
Compound notes
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