2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine

C10H4BrClF3NS — CID 102716460

IUPAC2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cc(Cl)nc(-c2sccc2Br)c1
InChIInChI=1S/C10H4BrClF3NS/c11-6-1-2-17-9(6)7-3-5(10(13,14)15)4-8(12)16-7/h1-4H
InChIKeyGJTHAABIYXMZJU-UHFFFAOYSA-N
MW342.57 g/mol
LogP5.24
Rot. Bonds1

About 2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine

2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine (PubChem CID 102716460) has the molecular formula C10H4BrClF3NS and a molecular weight of 342.57 g/mol. Its IUPAC name is 2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine
PubChem CID102716460
Molecular FormulaC10H4BrClF3NS
Molecular Weight342.57 g/mol
Exact Mass340.89
IUPAC Name2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cc(Cl)nc(-c2sccc2Br)c1
InChIInChI=1S/C10H4BrClF3NS/c11-6-1-2-17-9(6)7-3-5(10(13,14)15)4-8(12)16-7/h1-4H
InChIKeyGJTHAABIYXMZJU-UHFFFAOYSA-N
XLogP5.24
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.57
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(3-bromothiophen-2-yl)-2-chloro-6-(trifluoromethyl)pyrimidine
CID 114563128
6-(3-bromothiophen-2-yl)-N-ethyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106769719
2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine
CID 102716375
2-(3-bromothiophen-2-yl)-4-chloro-6-methylpyrimidine
CID 115380799
2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine
CID 102716286
N-(4-bromo-3-chlorophenyl)-6-chloro-4-(trifluoromethyl)pyridin-2-amine
CID 107615011
2-(3-bromothiophen-2-yl)-4-chloro-6-ethylpyrimidine
CID 115380801
2-chloro-6-(dibromomethyl)-4-(trifluoromethyl)pyridine
CID 87869815
6-chloro-N-(2,4-dibromophenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715636
4,6-dichloro-2-(3-chlorothiophen-2-yl)pyrimidine
CID 131008069
6-[6-chloro-4-(trifluoromethyl)-2-pyridinyl]quinoline
CID 102716462
N-(2-bromo-5-fluorophenyl)-6-chloro-4-(trifluoromethyl)pyridin-2-amine
CID 107637179

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine?
The IUPAC name of 2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine (CID 102716460) is 2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine is FC(F)(F)c1cc(Cl)nc(-c2sccc2Br)c1.
What is the InChIKey of 2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine?
The InChIKey is GJTHAABIYXMZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H4BrClF3NS/c11-6-1-2-17-9(6)7-3-5(10(13,14)15)4-8(12)16-7/h1-4H.
What are the key properties of 2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine?
2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine has a molecular weight of 342.57 g/mol, XLogP of 5.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 102716460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).