2-phenyl-1,1-dipyridin-3-ylethanol

C18H16N2O — CID 46885546

IUPAC2-phenyl-1,1-dipyridin-3-ylethanol
SMILESOC(Cc1ccccc1)(c1cccnc1)c1cccnc1
InChIInChI=1S/C18H16N2O/c21-18(16-8-4-10-19-13-16,17-9-5-11-20-14-17)12-15-6-2-1-3-7-15/h1-11,13-14,21H,12H2
InChIKeyISJDJRMNDVLGMU-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.96
Rot. Bonds4

About 2-phenyl-1,1-dipyridin-3-ylethanol

2-phenyl-1,1-dipyridin-3-ylethanol (PubChem CID 46885546) has the molecular formula C18H16N2O and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-phenyl-1,1-dipyridin-3-ylethanol.

Molecular Properties

Compound Name2-phenyl-1,1-dipyridin-3-ylethanol
PubChem CID46885546
Molecular FormulaC18H16N2O
Molecular Weight276.34 g/mol
Exact Mass276.13
IUPAC Name2-phenyl-1,1-dipyridin-3-ylethanol
SMILESOC(Cc1ccccc1)(c1cccnc1)c1cccnc1
InChIInChI=1S/C18H16N2O/c21-18(16-8-4-10-19-13-16,17-9-5-11-20-14-17)12-15-6-2-1-3-7-15/h1-11,13-14,21H,12H2
InChIKeyISJDJRMNDVLGMU-UHFFFAOYSA-N
XLogP2.96
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1,1-dipyridin-3-ylethanol?
The IUPAC name of 2-phenyl-1,1-dipyridin-3-ylethanol (CID 46885546) is 2-phenyl-1,1-dipyridin-3-ylethanol.
What is the SMILES notation for 2-phenyl-1,1-dipyridin-3-ylethanol?
The canonical SMILES for 2-phenyl-1,1-dipyridin-3-ylethanol is OC(Cc1ccccc1)(c1cccnc1)c1cccnc1.
What is the InChIKey of 2-phenyl-1,1-dipyridin-3-ylethanol?
The InChIKey is ISJDJRMNDVLGMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O/c21-18(16-8-4-10-19-13-16,17-9-5-11-20-14-17)12-15-6-2-1-3-7-15/h1-11,13-14,21H,12H2.
What are the key properties of 2-phenyl-1,1-dipyridin-3-ylethanol?
2-phenyl-1,1-dipyridin-3-ylethanol has a molecular weight of 276.34 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1,1-dipyridin-3-ylethanol is sourced from PubChem (CID 46885546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).