1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol

C14H14FNO2 — CID 54966198

IUPAC1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol
SMILESCOc1cccc(CC(O)c2cncc(F)c2)c1
InChIInChI=1S/C14H14FNO2/c1-18-13-4-2-3-10(5-13)6-14(17)11-7-12(15)9-16-8-11/h2-5,7-9,14,17H,6H2,1H3
InChIKeyLZQQBQJNJXCZSZ-UHFFFAOYSA-N
MW247.27 g/mol
LogP2.51
Rot. Bonds4

About 1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol

1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol (PubChem CID 54966198) has the molecular formula C14H14FNO2 and a molecular weight of 247.27 g/mol. Its IUPAC name is 1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol
PubChem CID54966198
Molecular FormulaC14H14FNO2
Molecular Weight247.27 g/mol
Exact Mass247.10
IUPAC Name1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol
SMILESCOc1cccc(CC(O)c2cncc(F)c2)c1
InChIInChI=1S/C14H14FNO2/c1-18-13-4-2-3-10(5-13)6-14(17)11-7-12(15)9-16-8-11/h2-5,7-9,14,17H,6H2,1H3
InChIKeyLZQQBQJNJXCZSZ-UHFFFAOYSA-N
XLogP2.51
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.27
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluoro-3,5-dimethylphenyl)-2-(3-methoxyphenyl)ethanol
CID 65297136
1-(4-fluoro-2-methylphenyl)-2-(3-methoxyphenyl)ethanol
CID 55115802
1-(3,5-dimethoxyphenyl)-2-(3-fluorophenyl)ethanol
CID 63016216
1-(2,4-difluorophenyl)-2-(3-methoxyphenyl)ethanol
CID 61088668
2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol
CID 105066229
1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine
CID 54967829
(5-fluoro-3-pyridinyl)-(5-methoxy-3-pyridinyl)methanol
CID 105121302
[(5-fluoro-3-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105191767
1-(3-methoxyphenyl)-3-pyridin-4-ylpropan-2-ol
CID 62608080
2-(3-methoxyphenyl)-1-pyridin-3-ylethanamine
CID 22299530
1-(4-methoxy-3-methylphenyl)-2-(3-methoxyphenyl)ethanol
CID 61080511
2-(4-methoxyphenyl)-1-(5-methyl-3-pyridinyl)ethanol
CID 115374094

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol?
The IUPAC name of 1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol (CID 54966198) is 1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol?
The canonical SMILES for 1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol is COc1cccc(CC(O)c2cncc(F)c2)c1.
What is the InChIKey of 1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol?
The InChIKey is LZQQBQJNJXCZSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO2/c1-18-13-4-2-3-10(5-13)6-14(17)11-7-12(15)9-16-8-11/h2-5,7-9,14,17H,6H2,1H3.
What are the key properties of 1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol?
1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol has a molecular weight of 247.27 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol is sourced from PubChem (CID 54966198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).