1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol

C13H11F2NO — CID 143762249

IUPAC1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol
SMILESCC(O)c1ccc(-c2ccc(F)cc2F)nc1
InChIInChI=1S/C13H11F2NO/c1-8(17)9-2-5-13(16-7-9)11-4-3-10(14)6-12(11)15/h2-8,17H,1H3
InChIKeyFGSPRNGCXJCYPS-UHFFFAOYSA-N
MW235.23 g/mol
LogP3.08
Rot. Bonds2

About 1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol

1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol (PubChem CID 143762249) has the molecular formula C13H11F2NO and a molecular weight of 235.23 g/mol. Its IUPAC name is 1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol.

Molecular Properties

Compound Name1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol
PubChem CID143762249
Molecular FormulaC13H11F2NO
Molecular Weight235.23 g/mol
Exact Mass235.08
IUPAC Name1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol
SMILESCC(O)c1ccc(-c2ccc(F)cc2F)nc1
InChIInChI=1S/C13H11F2NO/c1-8(17)9-2-5-13(16-7-9)11-4-3-10(14)6-12(11)15/h2-8,17H,1H3
InChIKeyFGSPRNGCXJCYPS-UHFFFAOYSA-N
XLogP3.08
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.23
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol?
The IUPAC name of 1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol (CID 143762249) is 1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol.
What is the SMILES notation for 1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol?
The canonical SMILES for 1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol is CC(O)c1ccc(-c2ccc(F)cc2F)nc1.
What is the InChIKey of 1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol?
The InChIKey is FGSPRNGCXJCYPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F2NO/c1-8(17)9-2-5-13(16-7-9)11-4-3-10(14)6-12(11)15/h2-8,17H,1H3.
What are the key properties of 1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol?
1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol has a molecular weight of 235.23 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol is sourced from PubChem (CID 143762249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).