2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine

C9H11F2NO — CID 130101198

IUPAC2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine
SMILESCOc1cc(C)nc(C(F)F)c1C
InChIInChI=1S/C9H11F2NO/c1-5-4-7(13-3)6(2)8(12-5)9(10)11/h4,9H,1-3H3
InChIKeyWBTOHJPIYIHNOU-UHFFFAOYSA-N
MW187.19 g/mol
LogP2.64
Rot. Bonds2

About 2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine

2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine (PubChem CID 130101198) has the molecular formula C9H11F2NO and a molecular weight of 187.19 g/mol. Its IUPAC name is 2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine.

Molecular Properties

Compound Name2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine
PubChem CID130101198
Molecular FormulaC9H11F2NO
Molecular Weight187.19 g/mol
Exact Mass187.08
IUPAC Name2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine
SMILESCOc1cc(C)nc(C(F)F)c1C
InChIInChI=1S/C9H11F2NO/c1-5-4-7(13-3)6(2)8(12-5)9(10)11/h4,9H,1-3H3
InChIKeyWBTOHJPIYIHNOU-UHFFFAOYSA-N
XLogP2.64
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.19
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(difluoromethyl)-3-methoxy-4,6-dimethylpyridine
CID 130101193
2-(difluoromethyl)-5,6-dimethoxy-3-methylpyridine
CID 130100894
2-(difluoromethyl)-3-methoxy-6-methylpyridine-4-carbonitrile
CID 118839081
2-(bromomethyl)-3-(difluoromethyl)-4-methoxy-6-methylpyridine
CID 130087789
2-cyclopropyl-4-methoxy-3,6-dimethylpyridine;ethane
CID 177024398
6-(difluoromethyl)-4-methoxy-3-methylpyridin-2-amine
CID 119005305
5-bromo-2-(difluoromethyl)-3-methoxy-6-methylpyridine
CID 130068654
[6-(difluoromethyl)-5-methoxy-2-methyl-3-pyridinyl]methanol
CID 118831655
[6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol
CID 130087896
6-(difluoromethyl)-3-methoxy-5-methylpyridine-2-carbaldehyde
CID 118814889
2-(difluoromethyl)-6-fluoro-3-iodo-4-methoxypyridine
CID 118826386
2-bromo-6-(difluoromethyl)-5-fluoro-3-methoxypyridine
CID 119009048

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine?
The IUPAC name of 2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine (CID 130101198) is 2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine.
What is the SMILES notation for 2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine?
The canonical SMILES for 2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine is COc1cc(C)nc(C(F)F)c1C.
What is the InChIKey of 2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine?
The InChIKey is WBTOHJPIYIHNOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F2NO/c1-5-4-7(13-3)6(2)8(12-5)9(10)11/h4,9H,1-3H3.
What are the key properties of 2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine?
2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine has a molecular weight of 187.19 g/mol, XLogP of 2.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-4-methoxy-3,6-dimethylpyridine is sourced from PubChem (CID 130101198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).