2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol

C13H10F3NO — CID 82920135

IUPAC2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
SMILESOC(Cc1ccc(F)c(F)c1)c1ccc(F)cn1
InChIInChI=1S/C13H10F3NO/c14-9-2-4-12(17-7-9)13(18)6-8-1-3-10(15)11(16)5-8/h1-5,7,13,18H,6H2
InChIKeyWDCKBEMANOSLBZ-UHFFFAOYSA-N
MW253.22 g/mol
LogP2.78
Rot. Bonds3

About 2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol

2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol (PubChem CID 82920135) has the molecular formula C13H10F3NO and a molecular weight of 253.22 g/mol. Its IUPAC name is 2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
PubChem CID82920135
Molecular FormulaC13H10F3NO
Molecular Weight253.22 g/mol
Exact Mass253.07
IUPAC Name2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
SMILESOC(Cc1ccc(F)c(F)c1)c1ccc(F)cn1
InChIInChI=1S/C13H10F3NO/c14-9-2-4-12(17-7-9)13(18)6-8-1-3-10(15)11(16)5-8/h1-5,7,13,18H,6H2
InChIKeyWDCKBEMANOSLBZ-UHFFFAOYSA-N
XLogP2.78
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.22
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol 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-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanamine
CID 82923360
2-(4-chloro-3-fluorophenyl)-1-(5-chloro-2-pyridinyl)ethanol
CID 114012664
2-(3-bromophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 79721739
1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol
CID 79723827
2-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 79721551
(1R)-2-amino-1-(5-fluoro-2-pyridinyl)ethanol
CID 83128440
2-(3-bromo-4-fluorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol
CID 105082327
2-(2-chloro-3-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 112653500
1-(2-chloro-5-fluorophenyl)-2-(3,4-difluorophenyl)ethanol
CID 105397725
1-(3,5-dichloro-2-pyridinyl)-2-(3,4-difluorophenyl)ethanol
CID 82920233
4,4,4-trifluoro-1-(5-fluoro-2-pyridinyl)butan-1-ol
CID 79722278
1-(5-chloro-2-pyridinyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105373532

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol?
The IUPAC name of 2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol (CID 82920135) is 2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol.
What is the SMILES notation for 2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol?
The canonical SMILES for 2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol is OC(Cc1ccc(F)c(F)c1)c1ccc(F)cn1.
What is the InChIKey of 2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol?
The InChIKey is WDCKBEMANOSLBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3NO/c14-9-2-4-12(17-7-9)13(18)6-8-1-3-10(15)11(16)5-8/h1-5,7,13,18H,6H2.
What are the key properties of 2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol?
2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol has a molecular weight of 253.22 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol is sourced from PubChem (CID 82920135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).