2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine

C8H8F3NO — CID 130080514

IUPAC2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine
SMILESCOc1cnc(C(F)F)c(C)c1F
InChIInChI=1S/C8H8F3NO/c1-4-6(9)5(13-2)3-12-7(4)8(10)11/h3,8H,1-2H3
InChIKeyKRCSOARYSACYAS-UHFFFAOYSA-N
MW191.15 g/mol
LogP2.48
Rot. Bonds2

About 2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine

2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine (PubChem CID 130080514) has the molecular formula C8H8F3NO and a molecular weight of 191.15 g/mol. Its IUPAC name is 2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine.

Molecular Properties

Compound Name2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine
PubChem CID130080514
Molecular FormulaC8H8F3NO
Molecular Weight191.15 g/mol
Exact Mass191.06
IUPAC Name2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine
SMILESCOc1cnc(C(F)F)c(C)c1F
InChIInChI=1S/C8H8F3NO/c1-4-6(9)5(13-2)3-12-7(4)8(10)11/h3,8H,1-2H3
InChIKeyKRCSOARYSACYAS-UHFFFAOYSA-N
XLogP2.48
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.15
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(difluoromethyl)-3,4-difluoro-5-methoxypyridine
CID 130099673
2-(difluoromethyl)-4-fluoro-3-methyl-5-(trifluoromethoxy)pyridine
CID 118826226
2-(difluoromethyl)-4-fluoro-5-methoxypyridin-3-amine
CID 130103884
2-(difluoromethyl)-4-fluoro-5-methoxypyridin-3-ol
CID 130079248
[2-(difluoromethyl)-4-fluoro-5-methoxy-3-pyridinyl]methanol
CID 130080710
2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide
CID 118826041
3-(bromomethyl)-2-(difluoromethyl)-5-methoxy-4-methylpyridine
CID 130087813
2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide
CID 118809416
2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carbonyl chloride
CID 118832244
2-chloro-3-(difluoromethyl)-4-fluoro-5-methoxypyridine
CID 119010666
6-(difluoromethyl)-4-fluoro-5-methylpyridine-3-sulfonamide
CID 118854245
5-chloro-2-(difluoromethyl)-3-methoxypyridine
CID 130095452

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine?
The IUPAC name of 2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine (CID 130080514) is 2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine.
What is the SMILES notation for 2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine?
The canonical SMILES for 2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine is COc1cnc(C(F)F)c(C)c1F.
What is the InChIKey of 2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine?
The InChIKey is KRCSOARYSACYAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3NO/c1-4-6(9)5(13-2)3-12-7(4)8(10)11/h3,8H,1-2H3.
What are the key properties of 2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine?
2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine has a molecular weight of 191.15 g/mol, XLogP of 2.48, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine is sourced from PubChem (CID 130080514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).