5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine

C9H8F5NO — CID 133100071

IUPAC5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine
SMILESCOc1cc(C(F)F)c(C(F)(F)F)nc1C
InChIInChI=1S/C9H8F5NO/c1-4-6(16-2)3-5(8(10)11)7(15-4)9(12,13)14/h3,8H,1-2H3
InChIKeyWRRLIYNXNPEHLQ-UHFFFAOYSA-N
MW241.16 g/mol
LogP3.36
Rot. Bonds2

About 5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine

5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine (PubChem CID 133100071) has the molecular formula C9H8F5NO and a molecular weight of 241.16 g/mol. Its IUPAC name is 5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine
PubChem CID133100071
Molecular FormulaC9H8F5NO
Molecular Weight241.16 g/mol
Exact Mass241.05
IUPAC Name5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine
SMILESCOc1cc(C(F)F)c(C(F)(F)F)nc1C
InChIInChI=1S/C9H8F5NO/c1-4-6(16-2)3-5(8(10)11)7(15-4)9(12,13)14/h3,8H,1-2H3
InChIKeyWRRLIYNXNPEHLQ-UHFFFAOYSA-N
XLogP3.36
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.16
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(difluoromethyl)-5-methoxy-6-(trifluoromethyl)pyridin-2-amine
CID 119019307
2-[5-(difluoromethyl)-3-methoxy-6-(trifluoromethyl)-2-pyridinyl]acetonitrile
CID 133099076
methyl 2-[5-(difluoromethyl)-2-methyl-6-(trifluoromethyl)-3-pyridinyl]acetate
CID 171029252
3-(difluoromethyl)-5-methoxy-6-(trifluoromethyl)pyridine-2-carbonitrile
CID 134669759
3-(difluoromethyl)-5-methoxy-6-methylpyridine-2-carboxamide
CID 133098966
methyl 2-[5-(difluoromethyl)-6-methyl-2-(trifluoromethyl)-3-pyridinyl]acetate
CID 171029223
4-(difluoromethyl)-3-fluoro-6-methoxy-2-(trifluoromethyl)pyridine
CID 118840685
[5-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol
CID 130087918
methyl 2-[5-(difluoromethyl)-2-iodo-6-(trifluoromethyl)-3-pyridinyl]acetate
CID 133100717
6-(difluoromethyl)-5-methoxy-2-(trifluoromethyl)pyridin-3-ol
CID 130083334
6-chloro-4-(difluoromethyl)-3-methoxy-2-(trifluoromethyl)pyridine
CID 130073838
4-(difluoromethyl)-8-methoxy-2-(trifluoromethyl)quinoline
CID 130247540

Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine?
The IUPAC name of 5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine (CID 133100071) is 5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine.
What is the SMILES notation for 5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine?
The canonical SMILES for 5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine is COc1cc(C(F)F)c(C(F)(F)F)nc1C.
What is the InChIKey of 5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine?
The InChIKey is WRRLIYNXNPEHLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F5NO/c1-4-6(16-2)3-5(8(10)11)7(15-4)9(12,13)14/h3,8H,1-2H3.
What are the key properties of 5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine?
5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine has a molecular weight of 241.16 g/mol, XLogP of 3.36, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethyl)-3-methoxy-2-methyl-6-(trifluoromethyl)pyridine is sourced from PubChem (CID 133100071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).