4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol

C8H8F3NO4 — CID 134665683

IUPAC4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol
SMILESCOc1cc(CO)c(O)c(OC(F)(F)F)n1
InChIInChI=1S/C8H8F3NO4/c1-15-5-2-4(3-13)6(14)7(12-5)16-8(9,10)11/h2,13-14H,3H2,1H3
InChIKeyYCGOXUZJLOYPDG-UHFFFAOYSA-N
MW239.15 g/mol
LogP1.19
Rot. Bonds3

About 4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol

4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol (PubChem CID 134665683) has the molecular formula C8H8F3NO4 and a molecular weight of 239.15 g/mol. Its IUPAC name is 4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol.

Molecular Properties

Compound Name4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol
PubChem CID134665683
Molecular FormulaC8H8F3NO4
Molecular Weight239.15 g/mol
Exact Mass239.04
IUPAC Name4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol
SMILESCOc1cc(CO)c(O)c(OC(F)(F)F)n1
InChIInChI=1S/C8H8F3NO4/c1-15-5-2-4(3-13)6(14)7(12-5)16-8(9,10)11/h2,13-14H,3H2,1H3
InChIKeyYCGOXUZJLOYPDG-UHFFFAOYSA-N
XLogP1.19
TPSA71.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.15
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(aminomethyl)-6-methoxy-2-(trifluoromethoxy)-3-pyridinyl]methanol
CID 134681809
[4-(chloromethyl)-6-methoxy-2-(trifluoromethoxy)-3-pyridinyl]methanol
CID 134669452
4-chloro-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol
CID 118817216
[4-(aminomethyl)-6-methoxy-3-(trifluoromethoxy)-2-pyridinyl]methanol
CID 118812946
[5-(aminomethyl)-2-methoxy-6-(trifluoromethoxy)-3-pyridinyl]methanol
CID 134680161
[3-methoxy-2-methyl-6-(trifluoromethoxy)-4-pyridinyl]methanol
CID 134663125
ethyl 2-[3-iodo-6-methoxy-2-(trifluoromethoxy)-4-pyridinyl]acetate
CID 134659134
[6-iodo-3-methoxy-2-(trifluoromethoxy)-4-pyridinyl]methanol
CID 134680765
[6-(chloromethyl)-3-methoxy-2-(trifluoromethoxy)-4-pyridinyl]methanol
CID 134681943
[6-(difluoromethyl)-3-methoxy-2-(trifluoromethoxy)-4-pyridinyl]methanol
CID 134681962
4-(bromomethyl)-6-methoxy-3-(trifluoromethoxy)-2-(trifluoromethyl)pyridine
CID 134671271
3-(bromomethyl)-6-methoxy-2-(trifluoromethoxy)-4-(trifluoromethyl)pyridine
CID 134671279

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol?
The IUPAC name of 4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol (CID 134665683) is 4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol.
What is the SMILES notation for 4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol?
The canonical SMILES for 4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol is COc1cc(CO)c(O)c(OC(F)(F)F)n1.
What is the InChIKey of 4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol?
The InChIKey is YCGOXUZJLOYPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3NO4/c1-15-5-2-4(3-13)6(14)7(12-5)16-8(9,10)11/h2,13-14H,3H2,1H3.
What are the key properties of 4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol?
4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol has a molecular weight of 239.15 g/mol, XLogP of 1.19, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-6-methoxy-2-(trifluoromethoxy)pyridin-3-ol is sourced from PubChem (CID 134665683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).