N-[1-(2-cyano-4-pyridinyl)propyl]-2-methylpropane-2-sulfinamide
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Basic information
- Standard SMILES
CCC(NS(=O)C(C)(C)C)c1ccnc(C#N)c1- InChIKey
GLJLMDMUSNWHHN-UHFFFAOYSA-N- Molecular formula
- C13H19N3OS
- Average molar mass
- 265.38 g/mol
- Monoisotopic mass
- 265.12488341
Names & identifiers
- IUPAC
- N-[1-(2-cyano-4-pyridinyl)propyl]-2-methylpropane-2-sulfinamide
Database identifiers
- PubChem CID
- 72244695
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 342
Related reactions
3 records
Compound notes
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