3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine

C14H9F6NO — CID 134627212

IUPAC3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine
SMILESCOc1ccc(C(F)(F)F)nc1-c1cccc(C(F)(F)F)c1
InChIInChI=1S/C14H9F6NO/c1-22-10-5-6-11(14(18,19)20)21-12(10)8-3-2-4-9(7-8)13(15,16)17/h2-7H,1H3
InChIKeyMOOXHKBBMMSQAJ-UHFFFAOYSA-N
MW321.22 g/mol
LogP4.79
Rot. Bonds2

About 3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine

3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine (PubChem CID 134627212) has the molecular formula C14H9F6NO and a molecular weight of 321.22 g/mol. Its IUPAC name is 3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine
PubChem CID134627212
Molecular FormulaC14H9F6NO
Molecular Weight321.22 g/mol
Exact Mass321.06
IUPAC Name3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine
SMILESCOc1ccc(C(F)(F)F)nc1-c1cccc(C(F)(F)F)c1
InChIInChI=1S/C14H9F6NO/c1-22-10-5-6-11(14(18,19)20)21-12(10)8-3-2-4-9(7-8)13(15,16)17/h2-7H,1H3
InChIKeyMOOXHKBBMMSQAJ-UHFFFAOYSA-N
XLogP4.79
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.22
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-iodo-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine
CID 134626985
2-fluoro-6-(trifluoromethyl)-3-[3-(trifluoromethyl)phenyl]pyridine
CID 133089838
4-methoxy-3-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine
CID 134628417
2-(4-fluorophenyl)-5-methoxy-4-[3-(trifluoromethyl)phenyl]pyrimidine
CID 11725302
2-(4-chlorophenyl)-5-methoxy-4-[3-(trifluoromethyl)phenyl]pyrimidine
CID 10428889
2-fluoro-6-methoxy-3-[3-(trifluoromethyl)phenyl]pyridine
CID 133089532
2-methoxy-1-methyl-4-[3-(trifluoromethyl)phenyl]benzene
CID 134627143
4-chloro-2-methoxy-1-[3-(trifluoromethyl)phenyl]benzene
CID 134627944
4-methoxy-3-methylsulfanyl-6-[3-(trifluoromethyl)phenyl]pyridazine
CID 19959667
1-methoxy-3-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]benzene
CID 119024630
[2-methoxy-5-methyl-4-[3-(trifluoromethyl)phenyl]phenyl]boronic acid
CID 123757639
8-methoxy-3-[3-(trifluoromethyl)phenyl]isoquinoline
CID 163359867

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine (CID 134627212) is 3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine is COc1ccc(C(F)(F)F)nc1-c1cccc(C(F)(F)F)c1.
What is the InChIKey of 3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine?
The InChIKey is MOOXHKBBMMSQAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F6NO/c1-22-10-5-6-11(14(18,19)20)21-12(10)8-3-2-4-9(7-8)13(15,16)17/h2-7H,1H3.
What are the key properties of 3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine?
3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine has a molecular weight of 321.22 g/mol, XLogP of 4.79, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 134627212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).