2,4-dimethyl-6-(trifluoromethoxy)pyridine

C8H8F3NO — CID 130088944

IUPAC2,4-dimethyl-6-(trifluoromethoxy)pyridine
SMILESCc1cc(C)nc(OC(F)(F)F)c1
InChIInChI=1S/C8H8F3NO/c1-5-3-6(2)12-7(4-5)13-8(9,10)11/h3-4H,1-2H3
InChIKeyVIIRYNHRFVMGRP-UHFFFAOYSA-N
MW191.15 g/mol
LogP2.60
Rot. Bonds1

About 2,4-dimethyl-6-(trifluoromethoxy)pyridine

2,4-dimethyl-6-(trifluoromethoxy)pyridine (PubChem CID 130088944) has the molecular formula C8H8F3NO and a molecular weight of 191.15 g/mol. Its IUPAC name is 2,4-dimethyl-6-(trifluoromethoxy)pyridine.

Molecular Properties

Compound Name2,4-dimethyl-6-(trifluoromethoxy)pyridine
PubChem CID130088944
Molecular FormulaC8H8F3NO
Molecular Weight191.15 g/mol
Exact Mass191.06
IUPAC Name2,4-dimethyl-6-(trifluoromethoxy)pyridine
SMILESCc1cc(C)nc(OC(F)(F)F)c1
InChIInChI=1S/C8H8F3NO/c1-5-3-6(2)12-7(4-5)13-8(9,10)11/h3-4H,1-2H3
InChIKeyVIIRYNHRFVMGRP-UHFFFAOYSA-N
XLogP2.60
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.15
LogP ≤ 52.60
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-(trifluoromethoxy)pyridine?
The IUPAC name of 2,4-dimethyl-6-(trifluoromethoxy)pyridine (CID 130088944) is 2,4-dimethyl-6-(trifluoromethoxy)pyridine.
What is the SMILES notation for 2,4-dimethyl-6-(trifluoromethoxy)pyridine?
The canonical SMILES for 2,4-dimethyl-6-(trifluoromethoxy)pyridine is Cc1cc(C)nc(OC(F)(F)F)c1.
What is the InChIKey of 2,4-dimethyl-6-(trifluoromethoxy)pyridine?
The InChIKey is VIIRYNHRFVMGRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3NO/c1-5-3-6(2)12-7(4-5)13-8(9,10)11/h3-4H,1-2H3.
What are the key properties of 2,4-dimethyl-6-(trifluoromethoxy)pyridine?
2,4-dimethyl-6-(trifluoromethoxy)pyridine has a molecular weight of 191.15 g/mol, XLogP of 2.60, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-(trifluoromethoxy)pyridine is sourced from PubChem (CID 130088944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).