[3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol

C8H9F2NO2 — CID 79156306

IUPAC[3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol
SMILESCc1ccc(OC(F)F)c(CO)n1
InChIInChI=1S/C8H9F2NO2/c1-5-2-3-7(13-8(9)10)6(4-12)11-5/h2-3,8,12H,4H2,1H3
InChIKeyOFCFVHRXUQSWMJ-UHFFFAOYSA-N
MW189.16 g/mol
LogP1.48
Rot. Bonds3

About [3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol

[3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol (PubChem CID 79156306) has the molecular formula C8H9F2NO2 and a molecular weight of 189.16 g/mol. Its IUPAC name is [3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol.

Molecular Properties

Compound Name[3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol
PubChem CID79156306
Molecular FormulaC8H9F2NO2
Molecular Weight189.16 g/mol
Exact Mass189.06
IUPAC Name[3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol
SMILESCc1ccc(OC(F)F)c(CO)n1
InChIInChI=1S/C8H9F2NO2/c1-5-2-3-7(13-8(9)10)6(4-12)11-5/h2-3,8,12H,4H2,1H3
InChIKeyOFCFVHRXUQSWMJ-UHFFFAOYSA-N
XLogP1.48
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.16
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol?
The IUPAC name of [3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol (CID 79156306) is [3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol.
What is the SMILES notation for [3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol?
The canonical SMILES for [3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol is Cc1ccc(OC(F)F)c(CO)n1.
What is the InChIKey of [3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol?
The InChIKey is OFCFVHRXUQSWMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F2NO2/c1-5-2-3-7(13-8(9)10)6(4-12)11-5/h2-3,8,12H,4H2,1H3.
What are the key properties of [3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol?
[3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol has a molecular weight of 189.16 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(difluoromethoxy)-6-methyl-2-pyridinyl]methanol is sourced from PubChem (CID 79156306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).