3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine

C8H7F4N — CID 153337824

IUPAC3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine
SMILESCc1ccc(CF)c(C(F)(F)F)n1
InChIInChI=1S/C8H7F4N/c1-5-2-3-6(4-9)7(13-5)8(10,11)12/h2-3H,4H2,1H3
InChIKeyYBIWAIRTCWNPGP-UHFFFAOYSA-N
MW193.14 g/mol
LogP2.88
Rot. Bonds1

About 3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine

3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine (PubChem CID 153337824) has the molecular formula C8H7F4N and a molecular weight of 193.14 g/mol. Its IUPAC name is 3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine
PubChem CID153337824
Molecular FormulaC8H7F4N
Molecular Weight193.14 g/mol
Exact Mass193.05
IUPAC Name3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine
SMILESCc1ccc(CF)c(C(F)(F)F)n1
InChIInChI=1S/C8H7F4N/c1-5-2-3-6(4-9)7(13-5)8(10,11)12/h2-3H,4H2,1H3
InChIKeyYBIWAIRTCWNPGP-UHFFFAOYSA-N
XLogP2.88
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.14
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine?
The IUPAC name of 3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine (CID 153337824) is 3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine?
The canonical SMILES for 3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine is Cc1ccc(CF)c(C(F)(F)F)n1.
What is the InChIKey of 3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine?
The InChIKey is YBIWAIRTCWNPGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F4N/c1-5-2-3-6(4-9)7(13-5)8(10,11)12/h2-3H,4H2,1H3.
What are the key properties of 3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine?
3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine has a molecular weight of 193.14 g/mol, XLogP of 2.88, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(fluoromethyl)-6-methyl-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 153337824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).