2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine

C14H12F3NO — CID 119020699

IUPAC2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine
SMILESCc1cc(C)nc(-c2ccccc2OC(F)(F)F)c1
InChIInChI=1S/C14H12F3NO/c1-9-7-10(2)18-12(8-9)11-5-3-4-6-13(11)19-14(15,16)17/h3-8H,1-2H3
InChIKeyIAWCAMGCDACHQG-UHFFFAOYSA-N
MW267.25 g/mol
LogP4.26
Rot. Bonds2

About 2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine

2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine (PubChem CID 119020699) has the molecular formula C14H12F3NO and a molecular weight of 267.25 g/mol. Its IUPAC name is 2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine.

Molecular Properties

Compound Name2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine
PubChem CID119020699
Molecular FormulaC14H12F3NO
Molecular Weight267.25 g/mol
Exact Mass267.09
IUPAC Name2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine
SMILESCc1cc(C)nc(-c2ccccc2OC(F)(F)F)c1
InChIInChI=1S/C14H12F3NO/c1-9-7-10(2)18-12(8-9)11-5-3-4-6-13(11)19-14(15,16)17/h3-8H,1-2H3
InChIKeyIAWCAMGCDACHQG-UHFFFAOYSA-N
XLogP4.26
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.25
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine?
The IUPAC name of 2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine (CID 119020699) is 2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine.
What is the SMILES notation for 2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine?
The canonical SMILES for 2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine is Cc1cc(C)nc(-c2ccccc2OC(F)(F)F)c1.
What is the InChIKey of 2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine?
The InChIKey is IAWCAMGCDACHQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F3NO/c1-9-7-10(2)18-12(8-9)11-5-3-4-6-13(11)19-14(15,16)17/h3-8H,1-2H3.
What are the key properties of 2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine?
2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine has a molecular weight of 267.25 g/mol, XLogP of 4.26, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-[2-(trifluoromethoxy)phenyl]pyridine is sourced from PubChem (CID 119020699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).