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

C9H11F2NO2 — CID 130087896

IUPAC[6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol
SMILESCOc1cc(C(F)F)nc(CO)c1C
InChIInChI=1S/C9H11F2NO2/c1-5-7(4-13)12-6(9(10)11)3-8(5)14-2/h3,9,13H,4H2,1-2H3
InChIKeyAPRRNGCELJYYJV-UHFFFAOYSA-N
MW203.19 g/mol
LogP1.83
Rot. Bonds3

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

[6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol (PubChem CID 130087896) has the molecular formula C9H11F2NO2 and a molecular weight of 203.19 g/mol. Its IUPAC name is [6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol
PubChem CID130087896
Molecular FormulaC9H11F2NO2
Molecular Weight203.19 g/mol
Exact Mass203.08
IUPAC Name[6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol
SMILESCOc1cc(C(F)F)nc(CO)c1C
InChIInChI=1S/C9H11F2NO2/c1-5-7(4-13)12-6(9(10)11)3-8(5)14-2/h3,9,13H,4H2,1-2H3
InChIKeyAPRRNGCELJYYJV-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

[6-(difluoromethyl)-4-fluoro-3-methyl-2-pyridinyl]methanol
CID 130081090
6-(difluoromethyl)-4-methoxy-3-methylpyridin-2-amine
CID 119005305
2-(chloromethyl)-6-(difluoromethyl)-4-methoxypyridin-3-amine
CID 130105970
[6-(difluoromethyl)-5-methoxy-2-methyl-3-pyridinyl]methanol
CID 118831655
[5-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanol
CID 130087918
methyl 2-[3-bromo-6-(difluoromethyl)-4-methoxy-2-pyridinyl]acetate
CID 134670856
methyl 2-[6-(difluoromethyl)-3-iodo-4-methoxy-2-pyridinyl]acetate
CID 133102109
6-(difluoromethyl)-4-methoxy-2-methylpyridin-3-amine
CID 130105843
6-(difluoromethyl)-2-fluoro-4-methoxypyridin-3-ol
CID 130079256
2-(bromomethyl)-6-(difluoromethyl)-4-methoxy-3-(trifluoromethyl)pyridine
CID 118843944
[2-(bromomethyl)-6-(difluoromethyl)-3-methyl-4-pyridinyl]methanol
CID 118843989
2-[6-(difluoromethyl)-4-methoxy-2-methyl-3-pyridinyl]acetic acid
CID 133099700

Frequently Asked Questions

What is the IUPAC name of [6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol?
The IUPAC name of [6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol (CID 130087896) is [6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol.
What is the SMILES notation for [6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol?
The canonical SMILES for [6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol is COc1cc(C(F)F)nc(CO)c1C.
What is the InChIKey of [6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol?
The InChIKey is APRRNGCELJYYJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F2NO2/c1-5-7(4-13)12-6(9(10)11)3-8(5)14-2/h3,9,13H,4H2,1-2H3.
What are the key properties of [6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol?
[6-(difluoromethyl)-4-methoxy-3-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 [6-(difluoromethyl)-4-methoxy-3-methyl-2-pyridinyl]methanol is sourced from PubChem (CID 130087896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).