Pyridine-3-carboxamide--water (1/1)
Basic information
- CAS
917925-73-6- Standard SMILES
NC(=O)c1cccnc1.O- InChIKey
JYGBLFUCVAWHNM-UHFFFAOYSA-N- Molecular formula
- C6H8N2O2
- Average molar mass
- 140.14 g/mol
- Monoisotopic mass
- 140.0585775
Names & identifiers
- Preferred name
- Pyridine-3-carboxamide--water (1/1)
- IUPAC
- pyridine-3-carboxamide;hydrate
Names & synonyms
917925-73-6DTXSID90586267Pyridine-3-carboxamide--water (1/1)RefChem:1097310DTXCID90537032Pyridine-3-carboxamide hydratepyridine-3-carboxamide;hydrate3-Pyridinecarboxamide, hydrate (1:1)NICOTINAMIDE HYDRATEnicotinamide-waterSCHEMBL508960SCHEMBL4730414
Show more names
SCHEMBL23576525AKOS000279650
Database identifiers
- CAS
917925-73-6- PubChem CID
- 16638467
- DTXSID
DTXSID90586267
Properties
Computed structural properties
- Topological polar surface area
- 57 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 114
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…