1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol

C14H13F2NO — CID 66461531

IUPAC1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol
SMILESCc1ccc(CC(O)c2cccc(F)c2F)nc1
InChIInChI=1S/C14H13F2NO/c1-9-5-6-10(17-8-9)7-13(18)11-3-2-4-12(15)14(11)16/h2-6,8,13,18H,7H2,1H3
InChIKeyMFEAINNLODZDGG-UHFFFAOYSA-N
MW249.26 g/mol
LogP2.94
Rot. Bonds3

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

1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol (PubChem CID 66461531) has the molecular formula C14H13F2NO and a molecular weight of 249.26 g/mol. Its IUPAC name is 1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol.

Molecular Properties

Compound Name1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol
PubChem CID66461531
Molecular FormulaC14H13F2NO
Molecular Weight249.26 g/mol
Exact Mass249.10
IUPAC Name1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol
SMILESCc1ccc(CC(O)c2cccc(F)c2F)nc1
InChIInChI=1S/C14H13F2NO/c1-9-5-6-10(17-8-9)7-13(18)11-3-2-4-12(15)14(11)16/h2-6,8,13,18H,7H2,1H3
InChIKeyMFEAINNLODZDGG-UHFFFAOYSA-N
XLogP2.94
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.26
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanamine
CID 66446522
1-(2,3-difluorophenyl)-N-methyl-2-(5-methyl-2-pyridinyl)ethanamine
CID 66447887
1-(2-bromo-3-methylphenyl)-2-(5-methyl-2-pyridinyl)ethanol
CID 114024113
2-(5-ethyl-2-pyridinyl)-1-(2-fluoro-3-methylphenyl)ethanol
CID 115822367
1-(2,3-dimethoxyphenyl)-2-(5-methyl-2-pyridinyl)ethanol
CID 66460933
1-(2,6-difluorophenyl)-N-methyl-2-(5-methyl-2-pyridinyl)ethanamine
CID 66446542
1-(2-chloro-3-fluorophenyl)-N-ethyl-2-(5-methyl-2-pyridinyl)ethanamine
CID 81454622
1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanone
CID 66448501
1-(2,3-difluorophenyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol
CID 64784853
1-(furan-3-yl)-2-(5-methyl-2-pyridinyl)ethanol
CID 66461533
2-(5-methyl-2-pyridinyl)-1-naphthalen-1-ylethanamine
CID 66446913
1-(3-bromo-2-fluorophenyl)-N-methyl-2-(5-methyl-2-pyridinyl)ethanamine
CID 107955465

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol?
The IUPAC name of 1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol (CID 66461531) is 1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol.
What is the SMILES notation for 1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol?
The canonical SMILES for 1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol is Cc1ccc(CC(O)c2cccc(F)c2F)nc1.
What is the InChIKey of 1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol?
The InChIKey is MFEAINNLODZDGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2NO/c1-9-5-6-10(17-8-9)7-13(18)11-3-2-4-12(15)14(11)16/h2-6,8,13,18H,7H2,1H3.
What are the key properties of 1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol?
1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol has a molecular weight of 249.26 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanol is sourced from PubChem (CID 66461531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).