1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol

C13H10Cl2FNO — CID 118211475

IUPAC1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol
SMILESCC(O)c1cnc(-c2cc(Cl)ccc2F)cc1Cl
InChIInChI=1S/C13H10Cl2FNO/c1-7(18)10-6-17-13(5-11(10)15)9-4-8(14)2-3-12(9)16/h2-7,18H,1H3
InChIKeyTUIXUFOQXGRSKJ-UHFFFAOYSA-N
MW286.13 g/mol
LogP4.25
Rot. Bonds2

About 1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol

1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol (PubChem CID 118211475) has the molecular formula C13H10Cl2FNO and a molecular weight of 286.13 g/mol. Its IUPAC name is 1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol.

Molecular Properties

Compound Name1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol
PubChem CID118211475
Molecular FormulaC13H10Cl2FNO
Molecular Weight286.13 g/mol
Exact Mass285.01
IUPAC Name1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol
SMILESCC(O)c1cnc(-c2cc(Cl)ccc2F)cc1Cl
InChIInChI=1S/C13H10Cl2FNO/c1-7(18)10-6-17-13(5-11(10)15)9-4-8(14)2-3-12(9)16/h2-7,18H,1H3
InChIKeyTUIXUFOQXGRSKJ-UHFFFAOYSA-N
XLogP4.25
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.13
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,5-dichlorophenyl)-5-fluoropyridine
CID 118836279
[4-[[2-(5-chloro-2-fluorophenyl)-5-propan-2-yl-4-pyridinyl]amino]-3-pyridinyl]methanol
CID 118211486
methyl 4-[[2-(5-chloro-2-fluorophenyl)-5-propan-2-yl-4-pyridinyl]amino]pyridine-3-carboxylate
CID 118211355
1-[2-(3-chloro-4-fluorophenyl)-4-methylpyrimidin-5-yl]ethanol
CID 55182363
N'-[2-(5-chloro-2-fluorophenyl)-5-propan-2-yl-4-pyridinyl]-N-(1,3-dihydroxypropan-2-yl)pyridine-3-carbohydrazide
CID 156784539
1-[4-(2,5-dichlorophenyl)-1,3-thiazol-2-yl]ethanol
CID 63524563
6-(4-chloro-2-fluorophenyl)pyridin-3-ol
CID 83128256
N-[2-(5-chloro-2-fluorophenyl)-5-propan-2-yl-4-pyridinyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
CID 118211266
1-(5-chloro-2,4-difluorophenyl)ethanol
CID 117283331
4-chloro-2-[2-fluoro-5-(trifluoromethoxy)phenyl]-5-prop-1-en-2-ylpyridine
CID 118211174
1-[4-(5-chloro-2-fluorophenyl)-1,3-thiazol-2-yl]ethanamine
CID 116867670
2-(2,5-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde
CID 133091145

Frequently Asked Questions

What is the IUPAC name of 1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol?
The IUPAC name of 1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol (CID 118211475) is 1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol.
What is the SMILES notation for 1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol?
The canonical SMILES for 1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol is CC(O)c1cnc(-c2cc(Cl)ccc2F)cc1Cl.
What is the InChIKey of 1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol?
The InChIKey is TUIXUFOQXGRSKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2FNO/c1-7(18)10-6-17-13(5-11(10)15)9-4-8(14)2-3-12(9)16/h2-7,18H,1H3.
What are the key properties of 1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol?
1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol has a molecular weight of 286.13 g/mol, XLogP of 4.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-chloro-6-(5-chloro-2-fluorophenyl)-3-pyridinyl]ethanol is sourced from PubChem (CID 118211475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).