6-[(2-Pyridinylmethyl)sulfanyl]-3-pyridineamine
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Basic information
- Standard SMILES
Nc1ccc(SCc2ccccn2)nc1- InChIKey
HIHJWMXJFINXFD-UHFFFAOYSA-N- Molecular formula
- C11H11N3S
- Average molar mass
- 217.29 g/mol
Names & identifiers
- Preferred name
- 6-[(2-Pyridinylmethyl)sulfanyl]-3-pyridineamine
- IUPAC
- 6-(pyridin-2-ylmethylsulfanyl)pyridin-3-amine
Names & synonyms
SCHEMBL5657397HIHJWMXJFINXFD-UHFFFAOYSA-N6-[(2-pyridinylmethyl)sulfanyl]-3-pyridineamine
Database identifiers
- PubChem CID
- 43301487
Properties
Computed structural propertiesFilling in
- XLogP
- 1.5
- Topological polar surface area
- 77.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 189
Related reactions
2 records
Compound notes
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