Basic information
- CAS
1820707-92-3- Standard SMILES
CS(=O)(=O)c1cc(C(N)=O)ccn1- InChIKey
MVLQDOUUZWWRRP-UHFFFAOYSA-N- Molecular formula
- C7H8N2O3S
- Average molar mass
- 200.22 g/mol
- Monoisotopic mass
- 200.0255633
Names & identifiers
- Preferred name
- 2-(Methylsulfonyl)isonicotinamide
- IUPAC
- 2-methylsulfonylpyridine-4-carboxamide
Names & synonyms
2-(Methylsulfonyl)isonicotinamide1820707-92-32-METHANESULFONYLPYRIDINE-4-CARBOXAMIDE2-methylsulfonylpyridine-4-carboxamideMFCD281271994-Pyridinecarboxamide, 2-(methylsulfonyl)-SCHEMBL3124166DTXSID0012656132-(Methanesulfonyl)pyridine-4-carboxamideBS-31658CS-0081750D74411
Show more names
EN300-1653205F615488
Database identifiers
- CAS
1820707-92-3- PubChem CID
- 68520460
- DTXSID
DTXSID001265613
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 98.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 293
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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