1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol

C12H16FNO2 — CID 79721741

IUPAC1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol
SMILESOC(CC1CCOCC1)c1ccc(F)cn1
InChIInChI=1S/C12H16FNO2/c13-10-1-2-11(14-8-10)12(15)7-9-3-5-16-6-4-9/h1-2,8-9,12,15H,3-7H2
InChIKeyVJEZHQKPJARULQ-UHFFFAOYSA-N
MW225.26 g/mol
LogP2.07
Rot. Bonds3

About 1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol

1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol (PubChem CID 79721741) has the molecular formula C12H16FNO2 and a molecular weight of 225.26 g/mol. Its IUPAC name is 1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol.

Molecular Properties

Compound Name1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol
PubChem CID79721741
Molecular FormulaC12H16FNO2
Molecular Weight225.26 g/mol
Exact Mass225.12
IUPAC Name1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol
SMILESOC(CC1CCOCC1)c1ccc(F)cn1
InChIInChI=1S/C12H16FNO2/c13-10-1-2-11(14-8-10)12(15)7-9-3-5-16-6-4-9/h1-2,8-9,12,15H,3-7H2
InChIKeyVJEZHQKPJARULQ-UHFFFAOYSA-N
XLogP2.07
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanamine
CID 79723580
1-(5-fluoro-2-pyridinyl)-3-[methyl(oxan-4-ylmethyl)amino]propan-1-ol
CID 83126451
(5-fluoro-2-pyridinyl)-(oxan-4-yl)methanamine
CID 79721967
(1R)-2-amino-1-(5-fluoro-2-pyridinyl)ethanol
CID 83128440
2-(oxan-4-yl)-1-pyrimidin-2-ylethanol
CID 62608022
1-(4-fluorophenyl)-2-(oxolan-3-yl)ethanol
CID 103986410
1-(2,4-difluorophenyl)-3-(oxan-4-yl)propan-2-ol
CID 64560809
1-(6-methyl-3-pyridinyl)-2-(oxan-4-yl)ethanol
CID 104823049
1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol
CID 79723827
[2-(oxan-4-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethyl]hydrazine
CID 105298819
4,4,4-trifluoro-1-(5-fluoro-2-pyridinyl)butan-1-ol
CID 79722278
1-(5-fluoro-3-pyridinyl)-2-(oxan-4-yl)ethanamine
CID 105138825

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol?
The IUPAC name of 1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol (CID 79721741) is 1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol.
What is the SMILES notation for 1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol?
The canonical SMILES for 1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol is OC(CC1CCOCC1)c1ccc(F)cn1.
What is the InChIKey of 1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol?
The InChIKey is VJEZHQKPJARULQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO2/c13-10-1-2-11(14-8-10)12(15)7-9-3-5-16-6-4-9/h1-2,8-9,12,15H,3-7H2.
What are the key properties of 1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol?
1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol has a molecular weight of 225.26 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-pyridinyl)-2-(oxan-4-yl)ethanol is sourced from PubChem (CID 79721741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).