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

C8H8F3NO — CID 130081129

IUPAC[3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol
SMILESCc1nc(F)cc(CO)c1C(F)F
InChIInChI=1S/C8H8F3NO/c1-4-7(8(10)11)5(3-13)2-6(9)12-4/h2,8,13H,3H2,1H3
InChIKeyZDZMEHNQMFEFCG-UHFFFAOYSA-N
MW191.15 g/mol
LogP1.96
Rot. Bonds2

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

[3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol (PubChem CID 130081129) has the molecular formula C8H8F3NO and a molecular weight of 191.15 g/mol. Its IUPAC name is [3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol.

Molecular Properties

Compound Name[3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol
PubChem CID130081129
Molecular FormulaC8H8F3NO
Molecular Weight191.15 g/mol
Exact Mass191.06
IUPAC Name[3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol
SMILESCc1nc(F)cc(CO)c1C(F)F
InChIInChI=1S/C8H8F3NO/c1-4-7(8(10)11)5(3-13)2-6(9)12-4/h2,8,13H,3H2,1H3
InChIKeyZDZMEHNQMFEFCG-UHFFFAOYSA-N
XLogP1.96
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.15
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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

[6-amino-3-(difluoromethyl)-2-methyl-4-pyridinyl]methanol
CID 130106484
[3-(difluoromethyl)-6-fluoro-2-methoxy-4-pyridinyl]methanol
CID 130080748
[2-(bromomethyl)-3-(difluoromethyl)-6-fluoro-4-pyridinyl]methanol
CID 130081815
[4-(bromomethyl)-3-(difluoromethyl)-6-fluoro-2-pyridinyl]methanol
CID 130081862
5-(difluoromethyl)-4-(hydroxymethyl)-6-methyl-1H-pyridin-2-one
CID 130083894
[6-(difluoromethyl)-2-fluoro-5-methyl-3-pyridinyl]methanol
CID 130081099
[6-amino-3-(difluoromethyl)-2-(trifluoromethyl)-4-pyridinyl]methanol
CID 130107727
4-(bromomethyl)-5-(difluoromethyl)-6-methylpyridin-2-amine
CID 130106319
[3-(difluoromethyl)-6-fluoro-2-(trifluoromethyl)-4-pyridinyl]methanamine
CID 130081572
[6-(difluoromethyl)-5-methoxy-2-methyl-3-pyridinyl]methanol
CID 118831655
[3-(difluoromethyl)-6-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol
CID 133103764
[6-(difluoromethyl)-2,4-dimethyl-3-pyridinyl]methanol
CID 130101372

Frequently Asked Questions

What is the IUPAC name of [3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol?
The IUPAC name of [3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol (CID 130081129) is [3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol.
What is the SMILES notation for [3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol?
The canonical SMILES for [3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol is Cc1nc(F)cc(CO)c1C(F)F.
What is the InChIKey of [3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol?
The InChIKey is ZDZMEHNQMFEFCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3NO/c1-4-7(8(10)11)5(3-13)2-6(9)12-4/h2,8,13H,3H2,1H3.
What are the key properties of [3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol?
[3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol has a molecular weight of 191.15 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(difluoromethyl)-6-fluoro-2-methyl-4-pyridinyl]methanol is sourced from PubChem (CID 130081129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).