4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol

C8H9F2NO3 — CID 118835243

IUPAC4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol
SMILESCOc1cnc(CO)c(O)c1C(F)F
InChIInChI=1S/C8H9F2NO3/c1-14-5-2-11-4(3-12)7(13)6(5)8(9)10/h2,8,12-13H,3H2,1H3
InChIKeyRTXBLBYMOWZMDM-UHFFFAOYSA-N
MW205.16 g/mol
LogP1.23
Rot. Bonds3

About 4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol

4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol (PubChem CID 118835243) has the molecular formula C8H9F2NO3 and a molecular weight of 205.16 g/mol. Its IUPAC name is 4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol.

Molecular Properties

Compound Name4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol
PubChem CID118835243
Molecular FormulaC8H9F2NO3
Molecular Weight205.16 g/mol
Exact Mass205.06
IUPAC Name4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol
SMILESCOc1cnc(CO)c(O)c1C(F)F
InChIInChI=1S/C8H9F2NO3/c1-14-5-2-11-4(3-12)7(13)6(5)8(9)10/h2,8,12-13H,3H2,1H3
InChIKeyRTXBLBYMOWZMDM-UHFFFAOYSA-N
XLogP1.23
TPSA62.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.16
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-(difluoromethyl)-3-hydroxy-5-methoxy-2-pyridinyl]acetonitrile
CID 118823951
[4-(difluoromethyl)-3-iodo-5-methoxy-2-pyridinyl]methanol
CID 130085739
[4-(difluoromethyl)-5-methoxy-3-(trifluoromethoxy)-2-pyridinyl]methanol
CID 118824029
[4-(difluoromethyl)-5-methoxy-2-(trifluoromethyl)-3-pyridinyl]methanol
CID 118824102
5-(difluoromethyl)-6-(hydroxymethyl)-4-methoxypyridin-3-ol
CID 130083427
methyl 4-(difluoromethyl)-3-hydroxy-5-methoxypyridine-2-carboxylate
CID 133103469
4-(difluoromethyl)-3-hydroxy-5-methoxypyridine-2-carbonyl chloride
CID 118845809
2-(chloromethyl)-4-(difluoromethyl)-3,5-dimethoxypyridine
CID 118854941
[4-amino-3-(difluoromethyl)-5-(trifluoromethoxy)-2-pyridinyl]methanol
CID 118851542
2-(bromomethyl)-3-(difluoromethyl)-5-methoxy-4-methylpyridine
CID 130087790
methyl 2-[3-(chloromethyl)-4-(difluoromethyl)-5-methoxy-2-pyridinyl]acetate
CID 133099014
2-[3-chloro-4-(difluoromethyl)-5-methoxy-2-pyridinyl]acetonitrile
CID 134674914

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol?
The IUPAC name of 4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol (CID 118835243) is 4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol.
What is the SMILES notation for 4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol?
The canonical SMILES for 4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol is COc1cnc(CO)c(O)c1C(F)F.
What is the InChIKey of 4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol?
The InChIKey is RTXBLBYMOWZMDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F2NO3/c1-14-5-2-11-4(3-12)7(13)6(5)8(9)10/h2,8,12-13H,3H2,1H3.
What are the key properties of 4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol?
4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol has a molecular weight of 205.16 g/mol, XLogP of 1.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-2-(hydroxymethyl)-5-methoxypyridin-3-ol is sourced from PubChem (CID 118835243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).