2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine

C10H5ClF3NS2 — CID 102716286

IUPAC2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cc(Cl)nc(Sc2cccs2)c1
InChIInChI=1S/C10H5ClF3NS2/c11-7-4-6(10(12,13)14)5-8(15-7)17-9-2-1-3-16-9/h1-5H
InChIKeyQQONNNRXRJXBNM-UHFFFAOYSA-N
MW295.74 g/mol
LogP4.97
Rot. Bonds2

About 2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine

2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine (PubChem CID 102716286) has the molecular formula C10H5ClF3NS2 and a molecular weight of 295.74 g/mol. Its IUPAC name is 2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine
PubChem CID102716286
Molecular FormulaC10H5ClF3NS2
Molecular Weight295.74 g/mol
Exact Mass294.95
IUPAC Name2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cc(Cl)nc(Sc2cccs2)c1
InChIInChI=1S/C10H5ClF3NS2/c11-7-4-6(10(12,13)14)5-8(15-7)17-9-2-1-3-16-9/h1-5H
InChIKeyQQONNNRXRJXBNM-UHFFFAOYSA-N
XLogP4.97
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.74
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-6-(2-chlorophenyl)sulfanyl-4-(trifluoromethyl)pyridine
CID 102716297
2-chloro-6-(4-propan-2-ylphenyl)sulfanyl-4-(trifluoromethyl)pyridine
CID 102716296
4-chloro-6-thiophen-2-ylsulfanylpyrimidine
CID 61279172
2-chloro-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridine
CID 102715246
4-chloro-2-thiophen-2-ylsulfanyl-1,3-thiazole
CID 83156010
N,2-dimethyl-6-thiophen-2-ylsulfanylpyrimidin-4-amine
CID 80886717
2-chloro-6-[(4-chlorophenyl)methylsulfanyl]-4-(trifluoromethyl)pyridine
CID 102716369
2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine
CID 102716460
2-[[6-chloro-4-(trifluoromethyl)-2-pyridinyl]sulfanyl]ethanamine;hydrochloride
CID 57365418
2-chloro-6-(1-cyclopropyltetrazol-5-yl)sulfanyl-4-(trifluoromethyl)pyridine
CID 102716303
2-chloro-6-cyclohexylsulfanyl-4-(trifluoromethyl)pyridine
CID 102716318
4-fluoro-6-thiophen-2-ylsulfanylpyrimidine
CID 115417285

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine?
The IUPAC name of 2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine (CID 102716286) is 2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine?
The canonical SMILES for 2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine is FC(F)(F)c1cc(Cl)nc(Sc2cccs2)c1.
What is the InChIKey of 2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine?
The InChIKey is QQONNNRXRJXBNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5ClF3NS2/c11-7-4-6(10(12,13)14)5-8(15-7)17-9-2-1-3-16-9/h1-5H.
What are the key properties of 2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine?
2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine has a molecular weight of 295.74 g/mol, XLogP of 4.97, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 102716286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).