2-(difluoromethyl)-5-(trifluoromethyl)pyridine

C7H4F5N — CID 130094479

IUPAC2-(difluoromethyl)-5-(trifluoromethyl)pyridine
SMILESFC(F)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C7H4F5N/c8-6(9)5-2-1-4(3-13-5)7(10,11)12/h1-3,6H
InChIKeyCBFFKBAYQIKQFK-UHFFFAOYSA-N
MW197.11 g/mol
LogP3.04
Rot. Bonds1

About 2-(difluoromethyl)-5-(trifluoromethyl)pyridine

2-(difluoromethyl)-5-(trifluoromethyl)pyridine (PubChem CID 130094479) has the molecular formula C7H4F5N and a molecular weight of 197.11 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-(difluoromethyl)-5-(trifluoromethyl)pyridine
PubChem CID130094479
Molecular FormulaC7H4F5N
Molecular Weight197.11 g/mol
Exact Mass197.03
IUPAC Name2-(difluoromethyl)-5-(trifluoromethyl)pyridine
SMILESFC(F)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C7H4F5N/c8-6(9)5-2-1-4(3-13-5)7(10,11)12/h1-3,6H
InChIKeyCBFFKBAYQIKQFK-UHFFFAOYSA-N
XLogP3.04
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.11
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

bis[5-(trifluoromethyl)-2-pyridinyl]methanol
CID 170433737
2-(3-chlorobutan-2-yl)-5-(trifluoromethyl)pyridine
CID 63202926
4,4,4-trifluoro-1-[5-(trifluoromethyl)-2-pyridinyl]butan-1-amine
CID 105156496
N,N-dimethyl-2-[5-(trifluoromethyl)-2-pyridinyl]propanamide
CID 177429162
3-ethyl-1-[5-(trifluoromethyl)-2-pyridinyl]pentan-1-amine
CID 105176912
4,4,4-trifluoro-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]butan-1-amine
CID 105156292
1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105157141
2-cyclopropyl-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
CID 112693374
2-methyl-5-(trifluoromethyl)pyridine
CID 18361873
6-(difluoromethyl)pyridin-3-ol
CID 56956232
1-(4-fluorophenyl)-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105087924
[5-(trifluoromethyl)-2-pyridinyl]-(2,4,5-trimethylphenyl)methanol
CID 105103565

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-(trifluoromethyl)pyridine?
The IUPAC name of 2-(difluoromethyl)-5-(trifluoromethyl)pyridine (CID 130094479) is 2-(difluoromethyl)-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(difluoromethyl)-5-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(difluoromethyl)-5-(trifluoromethyl)pyridine is FC(F)c1ccc(C(F)(F)F)cn1.
What is the InChIKey of 2-(difluoromethyl)-5-(trifluoromethyl)pyridine?
The InChIKey is CBFFKBAYQIKQFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F5N/c8-6(9)5-2-1-4(3-13-5)7(10,11)12/h1-3,6H.
What are the key properties of 2-(difluoromethyl)-5-(trifluoromethyl)pyridine?
2-(difluoromethyl)-5-(trifluoromethyl)pyridine has a molecular weight of 197.11 g/mol, XLogP of 3.04, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 130094479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).