2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol

C18H15FN2O — CID 57425700

IUPAC2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol
SMILESOC(Cc1ccc(F)cc1)(c1cccnc1)c1cccnc1
InChIInChI=1S/C18H15FN2O/c19-17-7-5-14(6-8-17)11-18(22,15-3-1-9-20-12-15)16-4-2-10-21-13-16/h1-10,12-13,22H,11H2
InChIKeyFBHHKKJIWDRXOR-UHFFFAOYSA-N
MW294.33 g/mol
LogP3.09
Rot. Bonds4

About 2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol

2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol (PubChem CID 57425700) has the molecular formula C18H15FN2O and a molecular weight of 294.33 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol
PubChem CID57425700
Molecular FormulaC18H15FN2O
Molecular Weight294.33 g/mol
Exact Mass294.12
IUPAC Name2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol
SMILESOC(Cc1ccc(F)cc1)(c1cccnc1)c1cccnc1
InChIInChI=1S/C18H15FN2O/c19-17-7-5-14(6-8-17)11-18(22,15-3-1-9-20-12-15)16-4-2-10-21-13-16/h1-10,12-13,22H,11H2
InChIKeyFBHHKKJIWDRXOR-UHFFFAOYSA-N
XLogP3.09
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol?
The IUPAC name of 2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol (CID 57425700) is 2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol.
What is the SMILES notation for 2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol?
The canonical SMILES for 2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol is OC(Cc1ccc(F)cc1)(c1cccnc1)c1cccnc1.
What is the InChIKey of 2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol?
The InChIKey is FBHHKKJIWDRXOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O/c19-17-7-5-14(6-8-17)11-18(22,15-3-1-9-20-12-15)16-4-2-10-21-13-16/h1-10,12-13,22H,11H2.
What are the key properties of 2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol?
2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol has a molecular weight of 294.33 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1,1-dipyridin-3-ylethanol is sourced from PubChem (CID 57425700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).