[4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol

C9H11F2NO2 — CID 130087924

IUPAC[4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol
SMILESCOc1c(C(F)F)cc(C)nc1CO
InChIInChI=1S/C9H11F2NO2/c1-5-3-6(9(10)11)8(14-2)7(4-13)12-5/h3,9,13H,4H2,1-2H3
InChIKeyKZTOLBMZOIDDIM-UHFFFAOYSA-N
MW203.19 g/mol
LogP1.83
Rot. Bonds3

About [4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol

[4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol (PubChem CID 130087924) has the molecular formula C9H11F2NO2 and a molecular weight of 203.19 g/mol. Its IUPAC name is [4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol
PubChem CID130087924
Molecular FormulaC9H11F2NO2
Molecular Weight203.19 g/mol
Exact Mass203.08
IUPAC Name[4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol
SMILESCOc1c(C(F)F)cc(C)nc1CO
InChIInChI=1S/C9H11F2NO2/c1-5-3-6(9(10)11)8(14-2)7(4-13)12-5/h3,9,13H,4H2,1-2H3
InChIKeyKZTOLBMZOIDDIM-UHFFFAOYSA-N
XLogP1.83
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.19
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanamine
CID 118819899
[6-bromo-4-(difluoromethyl)-3-methoxy-2-pyridinyl]methanol
CID 130068890
[5-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol
CID 130087918
ethyl 2-[6-chloro-4-(difluoromethyl)-3-methoxy-2-pyridinyl]acetate
CID 134669651
2-(chloromethyl)-4-(difluoromethyl)-6-iodo-3-methoxypyridine
CID 118809962
ethyl 2-[6-amino-4-(difluoromethyl)-3-methoxy-2-pyridinyl]acetate
CID 134683798
methyl 2-[3-bromo-4-(difluoromethyl)-6-methyl-2-pyridinyl]acetate
CID 134675923
[3-chloro-5-(difluoromethyl)-4-methoxy-2-pyridinyl]methanol
CID 130073890
[6-bromo-3-(difluoromethyl)-5-methoxy-2-pyridinyl]methanol
CID 119000833
[3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol
CID 130068914
[4-(difluoromethyl)-6-methoxy-5-methyl-2-pyridinyl]methanol
CID 118806611
[5-bromo-3-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol
CID 130068911

Frequently Asked Questions

What is the IUPAC name of [4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol?
The IUPAC name of [4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol (CID 130087924) is [4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol.
What is the SMILES notation for [4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol?
The canonical SMILES for [4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol is COc1c(C(F)F)cc(C)nc1CO.
What is the InChIKey of [4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol?
The InChIKey is KZTOLBMZOIDDIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F2NO2/c1-5-3-6(9(10)11)8(14-2)7(4-13)12-5/h3,9,13H,4H2,1-2H3.
What are the key properties of [4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol?
[4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol has a molecular weight of 203.19 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol is sourced from PubChem (CID 130087924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).