1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol

C19H16FNO — CID 67902820

IUPAC1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol
SMILESOC(Cc1ccc(-c2ccncc2)cc1)c1ccc(F)cc1
InChIInChI=1S/C19H16FNO/c20-18-7-5-17(6-8-18)19(22)13-14-1-3-15(4-2-14)16-9-11-21-12-10-16/h1-12,19,22H,13H2
InChIKeyRRMCWUSBMOVUPW-UHFFFAOYSA-N
MW293.34 g/mol
LogP4.16
Rot. Bonds4

About 1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol

1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol (PubChem CID 67902820) has the molecular formula C19H16FNO and a molecular weight of 293.34 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol
PubChem CID67902820
Molecular FormulaC19H16FNO
Molecular Weight293.34 g/mol
Exact Mass293.12
IUPAC Name1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol
SMILESOC(Cc1ccc(-c2ccncc2)cc1)c1ccc(F)cc1
InChIInChI=1S/C19H16FNO/c20-18-7-5-17(6-8-18)19(22)13-14-1-3-15(4-2-14)16-9-11-21-12-10-16/h1-12,19,22H,13H2
InChIKeyRRMCWUSBMOVUPW-UHFFFAOYSA-N
XLogP4.16
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol?
The IUPAC name of 1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol (CID 67902820) is 1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol?
The canonical SMILES for 1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol is OC(Cc1ccc(-c2ccncc2)cc1)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol?
The InChIKey is RRMCWUSBMOVUPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FNO/c20-18-7-5-17(6-8-18)19(22)13-14-1-3-15(4-2-14)16-9-11-21-12-10-16/h1-12,19,22H,13H2.
What are the key properties of 1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol?
1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol has a molecular weight of 293.34 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-(4-pyridin-4-ylphenyl)ethanol is sourced from PubChem (CID 67902820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).