1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol

C13H10BrF2NO — CID 83125325

IUPAC1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
SMILESCC(O)(c1ccc(F)cn1)c1cc(Br)ccc1F
InChIInChI=1S/C13H10BrF2NO/c1-13(18,12-5-3-9(15)7-17-12)10-6-8(14)2-4-11(10)16/h2-7,18H,1H3
InChIKeyIMYYZRBJGKTWJG-UHFFFAOYSA-N
MW314.13 g/mol
LogP3.38
Rot. Bonds2

About 1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol

1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol (PubChem CID 83125325) has the molecular formula C13H10BrF2NO and a molecular weight of 314.13 g/mol. Its IUPAC name is 1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol.

Molecular Properties

Compound Name1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
PubChem CID83125325
Molecular FormulaC13H10BrF2NO
Molecular Weight314.13 g/mol
Exact Mass312.99
IUPAC Name1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
SMILESCC(O)(c1ccc(F)cn1)c1cc(Br)ccc1F
InChIInChI=1S/C13H10BrF2NO/c1-13(18,12-5-3-9(15)7-17-12)10-6-8(14)2-4-11(10)16/h2-7,18H,1H3
InChIKeyIMYYZRBJGKTWJG-UHFFFAOYSA-N
XLogP3.38
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.13
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(5-bromo-2-fluorophenyl)-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

1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)propan-1-ol
CID 112585785
1-(4-chloro-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 83124846
1-(4-bromo-2-fluorophenyl)-2-(5-fluoro-2-pyridinyl)propan-2-amine
CID 83125669
1-(2,6-difluoro-3-methylphenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 83124686
1-(5-bromo-2-fluorophenyl)-1-(2-methylphenyl)ethanol
CID 79743593
1-(5-fluoro-2-pyridinyl)-1-[4-(trifluoromethyl)-3-pyridinyl]ethanol
CID 102707464
1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol
CID 79743336
1-(2-fluoro-3-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 83125403
1-(2,5-difluorophenyl)-2-(5-fluoro-2-pyridinyl)propan-2-ol
CID 83125413
1-(4-bromothiophen-2-yl)-2-(5-fluoro-2-pyridinyl)propan-2-ol
CID 83125408
1-(5-bromo-2-fluorophenyl)-1-(3-methylthiophen-2-yl)ethanol
CID 79742355
2-(5-fluoro-2-pyridinyl)butan-2-ol
CID 83124844

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol?
The IUPAC name of 1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol (CID 83125325) is 1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol.
What is the SMILES notation for 1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol?
The canonical SMILES for 1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol is CC(O)(c1ccc(F)cn1)c1cc(Br)ccc1F.
What is the InChIKey of 1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol?
The InChIKey is IMYYZRBJGKTWJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrF2NO/c1-13(18,12-5-3-9(15)7-17-12)10-6-8(14)2-4-11(10)16/h2-7,18H,1H3.
What are the key properties of 1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol?
1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol has a molecular weight of 314.13 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol is sourced from PubChem (CID 83125325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).