6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine

C8H5F6N — CID 133105555

IUPAC6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine
SMILESCc1c(F)cc(C(F)F)nc1C(F)(F)F
InChIInChI=1S/C8H5F6N/c1-3-4(9)2-5(7(10)11)15-6(3)8(12,13)14/h2,7H,1H3
InChIKeyBSMPXTUQSKDPDN-UHFFFAOYSA-N
MW229.12 g/mol
LogP3.49
Rot. Bonds1

About 6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine

6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine (PubChem CID 133105555) has the molecular formula C8H5F6N and a molecular weight of 229.12 g/mol. Its IUPAC name is 6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine
PubChem CID133105555
Molecular FormulaC8H5F6N
Molecular Weight229.12 g/mol
Exact Mass229.03
IUPAC Name6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine
SMILESCc1c(F)cc(C(F)F)nc1C(F)(F)F
InChIInChI=1S/C8H5F6N/c1-3-4(9)2-5(7(10)11)15-6(3)8(12,13)14/h2,7H,1H3
InChIKeyBSMPXTUQSKDPDN-UHFFFAOYSA-N
XLogP3.49
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.12
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[6-(difluoromethyl)-4-fluoro-3-methyl-2-pyridinyl]methanol
CID 130081090
6-(difluoromethyl)-2-fluoro-4-methyl-3-(trifluoromethyl)pyridine
CID 133105561
4-bromo-6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-ol
CID 118839692
3-bromo-6-(difluoromethyl)-4-nitro-2-(trifluoromethyl)pyridine
CID 134663698
[6-(difluoromethyl)-3-iodo-2-(trifluoromethyl)-4-pyridinyl]methanamine
CID 130086829
4-(chloromethyl)-6-(difluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine
CID 130087399
6-(difluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridin-3-ol
CID 134663177
[4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol
CID 118829480
3-chloro-6-(difluoromethyl)-2-methyl-4-(trifluoromethyl)pyridine
CID 134672175
6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine
CID 130094791
methyl 6-(difluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine-4-carboxylate
CID 133100965
[6-(difluoromethyl)-2-fluoro-3-(trifluoromethyl)-4-pyridinyl]methanol
CID 133104348

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine?
The IUPAC name of 6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine (CID 133105555) is 6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine?
The canonical SMILES for 6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine is Cc1c(F)cc(C(F)F)nc1C(F)(F)F.
What is the InChIKey of 6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine?
The InChIKey is BSMPXTUQSKDPDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5F6N/c1-3-4(9)2-5(7(10)11)15-6(3)8(12,13)14/h2,7H,1H3.
What are the key properties of 6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine?
6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine has a molecular weight of 229.12 g/mol, XLogP of 3.49, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-4-fluoro-3-methyl-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 133105555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).