2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol

C13H10BrClFNO — CID 103443644

IUPAC2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol
SMILESOC(Cc1ccc(F)cc1Br)c1ncccc1Cl
InChIInChI=1S/C13H10BrClFNO/c14-10-7-9(16)4-3-8(10)6-12(18)13-11(15)2-1-5-17-13/h1-5,7,12,18H,6H2
InChIKeyDWDWRESZFYEZGI-UHFFFAOYSA-N
MW330.58 g/mol
LogP3.91
Rot. Bonds3

About 2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol

2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol (PubChem CID 103443644) has the molecular formula C13H10BrClFNO and a molecular weight of 330.58 g/mol. Its IUPAC name is 2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol
PubChem CID103443644
Molecular FormulaC13H10BrClFNO
Molecular Weight330.58 g/mol
Exact Mass328.96
IUPAC Name2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol
SMILESOC(Cc1ccc(F)cc1Br)c1ncccc1Cl
InChIInChI=1S/C13H10BrClFNO/c14-10-7-9(16)4-3-8(10)6-12(18)13-11(15)2-1-5-17-13/h1-5,7,12,18H,6H2
InChIKeyDWDWRESZFYEZGI-UHFFFAOYSA-N
XLogP3.91
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.58
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromo-2-chlorophenyl)-1-(3-chloro-2-pyridinyl)ethanol
CID 103443505
2-(2-bromo-4-fluorophenyl)-1-pyridin-2-ylethanol
CID 62608368
[2-(2-bromo-4-fluorophenyl)-1-(3-fluoro-2-pyridinyl)ethyl]hydrazine
CID 105257780
2-(4-chloro-3-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol
CID 107884392
2-(2-bromo-4-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol
CID 65150787
2-(2-bromo-4-fluorophenyl)-1-(4-chloro-2,5-difluorophenyl)ethanol
CID 115786975
2-(2-bromo-4-fluorophenyl)-1-(2-chloro-3-fluorophenyl)ethanol
CID 115786915
1-(2-bromo-4-fluorophenyl)-3-(3,4-dichlorophenyl)propan-2-ol
CID 63410897
1-(3-bromo-2-pyridinyl)-2-(3-chloro-4-fluorophenyl)ethanol
CID 103039701
1-(3-bromo-2-pyridinyl)-2-(2-chloro-3-fluorophenyl)ethanol
CID 113398316
1-(2-amino-5-fluorophenyl)-2-(2-bromo-4-fluorophenyl)ethanol
CID 82684547
[2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine
CID 105203629

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol?
The IUPAC name of 2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol (CID 103443644) is 2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol.
What is the SMILES notation for 2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol?
The canonical SMILES for 2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol is OC(Cc1ccc(F)cc1Br)c1ncccc1Cl.
What is the InChIKey of 2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol?
The InChIKey is DWDWRESZFYEZGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrClFNO/c14-10-7-9(16)4-3-8(10)6-12(18)13-11(15)2-1-5-17-13/h1-5,7,12,18H,6H2.
What are the key properties of 2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol?
2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol has a molecular weight of 330.58 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol is sourced from PubChem (CID 103443644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).