Basic information
- CAS
444288-94-2- Standard SMILES
O=C(Nc1cccnc1)ON1C(=O)CCC1=O- InChIKey
DQVUDXZMEAQWGR-UHFFFAOYSA-N- Molecular formula
- C10H9N3O4
- Average molar mass
- 235.2 g/mol
- Monoisotopic mass
- 235.05930577
Names & identifiers
- Preferred name
- 1-{[(Pyridin-3-yl)carbamoyl]oxy}pyrrolidine-2,5-dione
- IUPAC
- (2,5-dioxopyrrolidin-1-yl) N-pyridin-3-ylcarbamate
Names & synonyms
444288-94-21-{[(Pyridin-3-yl)carbamoyl]oxy}pyrrolidine-2,5-dione2,5-Dioxopyrrolidin-1-yl pyridin-3-ylcarbamate(2,5-dioxopyrrolidin-1-yl) N-pyridin-3-ylcarbamateSCHEMBL1962172DTXSID60727140DQVUDXZMEAQWGR-UHFFFAOYSA-Npyridin-3-yl-carbamic acid 2,5-dioxo-pyrrolidin-1-yl esterDB-087154(2,5-dioxopyrrolidinyloxy)-N-(3-pyridyl)carboxamide
Database identifiers
- CAS
444288-94-2- PubChem CID
- 57564952
- DTXSID
DTXSID60727140- Nikkaji
- J2.704.966D
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 88.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 328
Related reactions
3 records
Compound notes
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