1,2,3,6-Tetrahydro-4-(3-(methylthio)phenyl)pyridine

HCID 12988965

Basic information

CAS
346688-67-3
Standard SMILES
CSc1cccc(C2=CCNCC2)c1
InChIKey
SNWOGYXQQFQOME-UHFFFAOYSA-N
Molecular formula
C12H15NS
Average molar mass
205.32 g/mol
Monoisotopic mass
205.09252048

Names & identifiers

Preferred name
1,2,3,6-Tetrahydro-4-(3-(methylthio)phenyl)pyridine
IUPAC
4-(3-methylsulfanylphenyl)-1,2,3,6-tetrahydropyridine

Names & synonyms

346688-67-31,2,3,6-Tetrahydro-4-[3-(methylthio)phenyl]pyridine1,2,3,6-Tetrahydro-4-(3-(methylthio)phenyl)pyridineRefChem:2145904-(3-(methylthio)phenyl)-1,2,3,6-tetrahydropyridineSCHEMBL48211084-(3-Methylsulfanyl-phenyl)-1,2,3,6-tetrahydropyridineSNWOGYXQQFQOME-UHFFFAOYSA-NDTXSID201225196I770224-(3-Methylsulfanyl-phenyl)-1,2,3,6-tetrahydro-pyridine4-[3-(Methylsulfanyl)phenyl]-1,2,3,6-tetrahydropyridine

Database identifiers

CAS
346688-67-3
PubChem CID
12988965
DTXSID
DTXSID201225196

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
14

Related reactions

6 records

Compound notes

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