2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine

C12H5F6N — CID 118848870

IUPAC2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine
SMILESFc1cc(F)c(-c2ccccc2C(F)(F)F)nc1F
InChIInChI=1S/C12H5F6N/c13-8-5-9(14)11(15)19-10(8)6-3-1-2-4-7(6)12(16,17)18/h1-5H
InChIKeyISOFQIVYWRQNEB-UHFFFAOYSA-N
MW277.17 g/mol
LogP4.18
Rot. Bonds1

About 2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine

2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine (PubChem CID 118848870) has the molecular formula C12H5F6N and a molecular weight of 277.17 g/mol. Its IUPAC name is 2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine
PubChem CID118848870
Molecular FormulaC12H5F6N
Molecular Weight277.17 g/mol
Exact Mass277.03
IUPAC Name2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine
SMILESFc1cc(F)c(-c2ccccc2C(F)(F)F)nc1F
InChIInChI=1S/C12H5F6N/c13-8-5-9(14)11(15)19-10(8)6-3-1-2-4-7(6)12(16,17)18/h1-5H
InChIKeyISOFQIVYWRQNEB-UHFFFAOYSA-N
XLogP4.18
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.17
LogP ≤ 54.18
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

1,3-difluoro-2-[2-(trifluoromethyl)phenyl]benzene
CID 118991852
1-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]benzene
CID 3013906
1,2-difluoro-4-[2-(trifluoromethyl)phenyl]benzene
CID 91807915
2-fluoro-1-methyl-4-[2-(trifluoromethyl)phenyl]benzene
CID 123409269
3-methyl-2-[2-(trifluoromethyl)phenyl]quinoline
CID 132515262
1,2-difluoro-4-methyl-5-[2-(trifluoromethyl)phenyl]benzene
CID 158879468
4-fluoro-3-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]pyridine
CID 118850193
2,3,5-trifluoro-6-[3-(trifluoromethyl)phenyl]pyridine
CID 118803789
6-(trifluoromethyl)-2,4-bis[2-(trifluoromethyl)phenyl]pyridin-3-amine
CID 134624265
5-methyl-2,4-bis[2-(trifluoromethyl)phenyl]pyrimidine
CID 174722143
4,5-difluoro-2-[2-(trifluoromethyl)phenyl]phenol
CID 118823457
1,3-difluoro-2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]benzene
CID 118846513

Frequently Asked Questions

What is the IUPAC name of 2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine (CID 118848870) is 2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine is Fc1cc(F)c(-c2ccccc2C(F)(F)F)nc1F.
What is the InChIKey of 2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine?
The InChIKey is ISOFQIVYWRQNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H5F6N/c13-8-5-9(14)11(15)19-10(8)6-3-1-2-4-7(6)12(16,17)18/h1-5H.
What are the key properties of 2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine?
2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine has a molecular weight of 277.17 g/mol, XLogP of 4.18, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trifluoro-6-[2-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 118848870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).