1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol

C14H14FNO — CID 62791168

IUPAC1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol
SMILESCc1ccc(F)c(C(O)Cc2ccncc2)c1
InChIInChI=1S/C14H14FNO/c1-10-2-3-13(15)12(8-10)14(17)9-11-4-6-16-7-5-11/h2-8,14,17H,9H2,1H3
InChIKeyMMLRVVPYOJRCAE-UHFFFAOYSA-N
MW231.27 g/mol
LogP2.81
Rot. Bonds3

About 1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol

1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol (PubChem CID 62791168) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is 1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol.

Molecular Properties

Compound Name1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol
PubChem CID62791168
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC Name1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol
SMILESCc1ccc(F)c(C(O)Cc2ccncc2)c1
InChIInChI=1S/C14H14FNO/c1-10-2-3-13(15)12(8-10)14(17)9-11-4-6-16-7-5-11/h2-8,14,17H,9H2,1H3
InChIKeyMMLRVVPYOJRCAE-UHFFFAOYSA-N
XLogP2.81
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,5-difluorophenyl)-2-(4-methylphenyl)ethanol
CID 61099597
1-(2-fluoro-5-methylphenyl)-3-methylbutan-1-ol
CID 62789444
1-(2-fluoro-5-methylphenyl)-3,3-dimethylbutan-1-ol
CID 63891500
1-(4-methyl-3-pyridinyl)-2-pyridin-4-ylethanol
CID 66273541
1-(2-fluoro-5-methylphenyl)but-3-en-1-ol
CID 116659989
1-(2,5-difluorophenyl)-2-(3,5-dimethylphenyl)ethanol
CID 62802583
1-(2-fluoro-5-methylphenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 115820989
2-(4-bromothiophen-2-yl)-1-(2-fluoro-5-methylphenyl)ethanol
CID 115790170
2-(4-bromo-1,3-dimethylpyrazol-5-yl)-1-(2-fluoro-5-methylphenyl)ethanol
CID 115814385
1-(2-fluoro-5-methylphenyl)undecan-1-ol
CID 115789089
1-(4-chloro-2-fluorophenyl)-2-(4-methylphenyl)ethanol
CID 63016785
1-(5-chloro-2-fluorophenyl)-2-(2,5-dimethylphenyl)ethanol
CID 55149164

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol?
The IUPAC name of 1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol (CID 62791168) is 1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol.
What is the SMILES notation for 1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol?
The canonical SMILES for 1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol is Cc1ccc(F)c(C(O)Cc2ccncc2)c1.
What is the InChIKey of 1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol?
The InChIKey is MMLRVVPYOJRCAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c1-10-2-3-13(15)12(8-10)14(17)9-11-4-6-16-7-5-11/h2-8,14,17H,9H2,1H3.
What are the key properties of 1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol?
1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol has a molecular weight of 231.27 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylethanol is sourced from PubChem (CID 62791168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).