2-ethyl-4,6-bis(trifluoromethyl)pyridine

C9H7F6N — CID 133094723

IUPAC2-ethyl-4,6-bis(trifluoromethyl)pyridine
SMILESCCc1cc(C(F)(F)F)cc(C(F)(F)F)n1
InChIInChI=1S/C9H7F6N/c1-2-6-3-5(8(10,11)12)4-7(16-6)9(13,14)15/h3-4H,2H2,1H3
InChIKeyOHNGHJDMMOZEHB-UHFFFAOYSA-N
MW243.15 g/mol
LogP3.68
Rot. Bonds1

About 2-ethyl-4,6-bis(trifluoromethyl)pyridine

2-ethyl-4,6-bis(trifluoromethyl)pyridine (PubChem CID 133094723) has the molecular formula C9H7F6N and a molecular weight of 243.15 g/mol. Its IUPAC name is 2-ethyl-4,6-bis(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-ethyl-4,6-bis(trifluoromethyl)pyridine
PubChem CID133094723
Molecular FormulaC9H7F6N
Molecular Weight243.15 g/mol
Exact Mass243.05
IUPAC Name2-ethyl-4,6-bis(trifluoromethyl)pyridine
SMILESCCc1cc(C(F)(F)F)cc(C(F)(F)F)n1
InChIInChI=1S/C9H7F6N/c1-2-6-3-5(8(10,11)12)4-7(16-6)9(13,14)15/h3-4H,2H2,1H3
InChIKeyOHNGHJDMMOZEHB-UHFFFAOYSA-N
XLogP3.68
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.15
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-chloro-2-ethyl-6-(trifluoromethyl)pyridine
CID 172992269
2,4,6-tris(trifluoromethyl)pyridine
CID 14937918
ethyl 2-[4,6-bis(trifluoromethyl)-2-pyridinyl]acetate
CID 171030486
2-propan-2-yl-4,6-bis(trifluoromethyl)pyridine
CID 59664272
2-[[4,6-bis(trifluoromethyl)-2-pyridinyl]disulfanyl]-4,6-bis(trifluoromethyl)pyridine
CID 18951402
2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol
CID 10467229
ethane;3-ethyl-1-methyl-6-(trifluoromethyl)isoquinoline
CID 143771038
6-ethyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-amine
CID 62192267
2-tert-butyl-6-ethyl-4-methyl-3-(trifluoromethyl)pyridine
CID 158200030
methylidene-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]methyl]-λ3-iodane
CID 163799716
2-ethyl-6-(trifluoromethyl)pyrimidin-4-amine
CID 67511489
1-ethyl-3-iodo-5-(trifluoromethyl)benzene
CID 154475261

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4,6-bis(trifluoromethyl)pyridine?
The IUPAC name of 2-ethyl-4,6-bis(trifluoromethyl)pyridine (CID 133094723) is 2-ethyl-4,6-bis(trifluoromethyl)pyridine.
What is the SMILES notation for 2-ethyl-4,6-bis(trifluoromethyl)pyridine?
The canonical SMILES for 2-ethyl-4,6-bis(trifluoromethyl)pyridine is CCc1cc(C(F)(F)F)cc(C(F)(F)F)n1.
What is the InChIKey of 2-ethyl-4,6-bis(trifluoromethyl)pyridine?
The InChIKey is OHNGHJDMMOZEHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F6N/c1-2-6-3-5(8(10,11)12)4-7(16-6)9(13,14)15/h3-4H,2H2,1H3.
What are the key properties of 2-ethyl-4,6-bis(trifluoromethyl)pyridine?
2-ethyl-4,6-bis(trifluoromethyl)pyridine has a molecular weight of 243.15 g/mol, XLogP of 3.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4,6-bis(trifluoromethyl)pyridine is sourced from PubChem (CID 133094723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).