2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine

C12H5ClF5N — CID 102716375

IUPAC2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine
SMILESFc1cc(F)cc(-c2cc(C(F)(F)F)cc(Cl)n2)c1
InChIInChI=1S/C12H5ClF5N/c13-11-4-7(12(16,17)18)3-10(19-11)6-1-8(14)5-9(15)2-6/h1-5H
InChIKeyUNTINGCIRUSMGV-UHFFFAOYSA-N
MW293.62 g/mol
LogP4.70
Rot. Bonds1

About 2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine

2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine (PubChem CID 102716375) has the molecular formula C12H5ClF5N and a molecular weight of 293.62 g/mol. Its IUPAC name is 2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine
PubChem CID102716375
Molecular FormulaC12H5ClF5N
Molecular Weight293.62 g/mol
Exact Mass293.00
IUPAC Name2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine
SMILESFc1cc(F)cc(-c2cc(C(F)(F)F)cc(Cl)n2)c1
InChIInChI=1S/C12H5ClF5N/c13-11-4-7(12(16,17)18)3-10(19-11)6-1-8(14)5-9(15)2-6/h1-5H
InChIKeyUNTINGCIRUSMGV-UHFFFAOYSA-N
XLogP4.70
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.62
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-[6-chloro-4-(trifluoromethyl)-2-pyridinyl]quinoline
CID 102716462
4-chloro-2-cyclopropyl-6-(3,5-difluorophenyl)pyrimidine
CID 80952148
2-chloro-6-(2,3-dihydro-1-benzofuran-5-yl)-4-(trifluoromethyl)pyridine
CID 102716482
2-(3-bromothiophen-2-yl)-6-chloro-4-(trifluoromethyl)pyridine
CID 102716460
2-chloro-6-(difluoromethyl)-4-(trifluoromethyl)pyridine
CID 119003399
(2R)-2-[4-[6-chloro-4-(trifluoromethyl)-2-pyridinyl]phenoxy]propanoic acid
CID 97136587
1-chloro-3-fluoro-5-(trifluoromethyl)benzene
CID 19612353
6-(4-fluorophenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102716554
2-chloro-6-(3-fluoro-5-methylphenyl)pyridine
CID 79689816
2-chloro-6-(dibromomethyl)-4-(trifluoromethyl)pyridine
CID 87869815
2-chloro-4-cyclopropyl-6-[4-(trifluoromethyl)phenyl]pyridine
CID 57468630
5-[6-chloro-4-(trifluoromethyl)-2-pyridinyl]imidazo[1,2-a]pyridine
CID 102716508

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine?
The IUPAC name of 2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine (CID 102716375) is 2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine?
The canonical SMILES for 2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine is Fc1cc(F)cc(-c2cc(C(F)(F)F)cc(Cl)n2)c1.
What is the InChIKey of 2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine?
The InChIKey is UNTINGCIRUSMGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H5ClF5N/c13-11-4-7(12(16,17)18)3-10(19-11)6-1-8(14)5-9(15)2-6/h1-5H.
What are the key properties of 2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine?
2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine has a molecular weight of 293.62 g/mol, XLogP of 4.70, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(3,5-difluorophenyl)-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 102716375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).