2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol

C13H11ClFNO — CID 102617218

IUPAC2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol
SMILESOC(Cc1cc(F)ccc1Cl)c1ccncc1
InChIInChI=1S/C13H11ClFNO/c14-12-2-1-11(15)7-10(12)8-13(17)9-3-5-16-6-4-9/h1-7,13,17H,8H2
InChIKeyIFBAXRFDRIUCQI-UHFFFAOYSA-N
MW251.69 g/mol
LogP3.15
Rot. Bonds3

About 2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol

2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol (PubChem CID 102617218) has the molecular formula C13H11ClFNO and a molecular weight of 251.69 g/mol. Its IUPAC name is 2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol.

Molecular Properties

Compound Name2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol
PubChem CID102617218
Molecular FormulaC13H11ClFNO
Molecular Weight251.69 g/mol
Exact Mass251.05
IUPAC Name2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol
SMILESOC(Cc1cc(F)ccc1Cl)c1ccncc1
InChIInChI=1S/C13H11ClFNO/c14-12-2-1-11(15)7-10(12)8-13(17)9-3-5-16-6-4-9/h1-7,13,17H,8H2
InChIKeyIFBAXRFDRIUCQI-UHFFFAOYSA-N
XLogP3.15
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.69
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol 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-(5-chloro-2-fluorophenyl)-1-pyridin-4-ylethanol
CID 103047540
1-(2-chloro-5-fluorophenyl)-4-pyridin-4-ylbutan-2-ol
CID 102623110
2-(2-chloro-5-fluorophenyl)-1-(furan-3-yl)ethanol
CID 102617275
2-(2-chloro-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol
CID 102617223
3-(2-chloro-5-fluorophenyl)-1,1-difluoropropan-2-ol
CID 102618230
1-(4-fluorophenyl)-2-pyridin-4-ylethanol
CID 62553094
2-(2-chloro-5-fluorophenyl)-1-[3-(methoxymethyl)phenyl]ethanol
CID 102617340
2-(2-chloro-5-fluorophenyl)-1-naphthalen-1-ylethanol
CID 102617231
2-(2-chloro-5-fluorophenyl)-1-(2,4-dimethyl-1,3-thiazol-5-yl)ethanol
CID 114033903
2-(2-chloro-5-fluorophenyl)-1-(1,5-dimethylpyrazol-3-yl)ethanol
CID 114220171
2-(2-chloro-5-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol
CID 103373694
2-(2-chloro-5-fluorophenyl)-1-(3,6-dimethylpyridazin-4-yl)ethanol
CID 102623179

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol?
The IUPAC name of 2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol (CID 102617218) is 2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol.
What is the SMILES notation for 2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol?
The canonical SMILES for 2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol is OC(Cc1cc(F)ccc1Cl)c1ccncc1.
What is the InChIKey of 2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol?
The InChIKey is IFBAXRFDRIUCQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClFNO/c14-12-2-1-11(15)7-10(12)8-13(17)9-3-5-16-6-4-9/h1-7,13,17H,8H2.
What are the key properties of 2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol?
2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol has a molecular weight of 251.69 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol is sourced from PubChem (CID 102617218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).