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

C12H11FN2O — CID 79723827

IUPAC1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol
SMILESOC(Cc1ccncc1)c1ccc(F)cn1
InChIInChI=1S/C12H11FN2O/c13-10-1-2-11(15-8-10)12(16)7-9-3-5-14-6-4-9/h1-6,8,12,16H,7H2
InChIKeyBDBXLKAHDLCGCS-UHFFFAOYSA-N
MW218.23 g/mol
LogP1.89
Rot. Bonds3

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

1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol (PubChem CID 79723827) has the molecular formula C12H11FN2O and a molecular weight of 218.23 g/mol. Its IUPAC name is 1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol.

Molecular Properties

Compound Name1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol
PubChem CID79723827
Molecular FormulaC12H11FN2O
Molecular Weight218.23 g/mol
Exact Mass218.09
IUPAC Name1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol
SMILESOC(Cc1ccncc1)c1ccc(F)cn1
InChIInChI=1S/C12H11FN2O/c13-10-1-2-11(15-8-10)12(16)7-9-3-5-14-6-4-9/h1-6,8,12,16H,7H2
InChIKeyBDBXLKAHDLCGCS-UHFFFAOYSA-N
XLogP1.89
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.23
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 82920135
N-ethyl-1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanamine
CID 79713745
(1R)-2-amino-1-(5-fluoro-2-pyridinyl)ethanol
CID 83128440
1-(4-fluorophenyl)-2-pyridin-4-ylethanol
CID 62553094
2-(3-bromophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 79721739
4,4,4-trifluoro-1-(5-fluoro-2-pyridinyl)butan-1-ol
CID 79722278
1-(5-fluoro-3-pyridinyl)-2-pyridin-4-ylethanol
CID 62551931
2-(2-chloro-3-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 112653500
1-(5-fluoro-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethanol
CID 82870351
2-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 79721551
1-(5-fluoro-2-pyridinyl)-2-(2-propan-2-yl-1,2,4-triazol-3-yl)ethanol
CID 79723844
1-[5-(4-fluorophenyl)-1,2-thiazol-3-yl]-2-pyridin-4-ylethanol
CID 89477926

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol?
The IUPAC name of 1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol (CID 79723827) is 1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol.
What is the SMILES notation for 1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol?
The canonical SMILES for 1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol is OC(Cc1ccncc1)c1ccc(F)cn1.
What is the InChIKey of 1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol?
The InChIKey is BDBXLKAHDLCGCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2O/c13-10-1-2-11(15-8-10)12(16)7-9-3-5-14-6-4-9/h1-6,8,12,16H,7H2.
What are the key properties of 1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol?
1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol has a molecular weight of 218.23 g/mol, XLogP of 1.89, 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-pyridin-4-ylethanol is sourced from PubChem (CID 79723827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).