2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol

C22H16N2O2 — CID 137091036

IUPAC2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol
SMILESOc1cccc(-c2cc(-c3ccccn3)cc(-c3ccccc3O)n2)c1
InChIInChI=1S/C22H16N2O2/c25-17-7-5-6-15(12-17)20-13-16(19-9-3-4-11-23-19)14-21(24-20)18-8-1-2-10-22(18)26/h1-14,25-26H
InChIKeyVDWVVZCPHIUQCH-UHFFFAOYSA-N
MW340.38 g/mol
LogP4.89
Rot. Bonds3

About 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol

2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol (PubChem CID 137091036) has the molecular formula C22H16N2O2 and a molecular weight of 340.38 g/mol. Its IUPAC name is 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol.

Molecular Properties

Compound Name2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol
PubChem CID137091036
Molecular FormulaC22H16N2O2
Molecular Weight340.38 g/mol
Exact Mass340.12
IUPAC Name2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol
SMILESOc1cccc(-c2cc(-c3ccccn3)cc(-c3ccccc3O)n2)c1
InChIInChI=1S/C22H16N2O2/c25-17-7-5-6-15(12-17)20-13-16(19-9-3-4-11-23-19)14-21(24-20)18-8-1-2-10-22(18)26/h1-14,25-26H
InChIKeyVDWVVZCPHIUQCH-UHFFFAOYSA-N
XLogP4.89
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol?
The IUPAC name of 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol (CID 137091036) is 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol.
What is the SMILES notation for 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol?
The canonical SMILES for 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol is Oc1cccc(-c2cc(-c3ccccn3)cc(-c3ccccc3O)n2)c1.
What is the InChIKey of 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol?
The InChIKey is VDWVVZCPHIUQCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O2/c25-17-7-5-6-15(12-17)20-13-16(19-9-3-4-11-23-19)14-21(24-20)18-8-1-2-10-22(18)26/h1-14,25-26H.
What are the key properties of 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol?
2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol has a molecular weight of 340.38 g/mol, XLogP of 4.89, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol is sourced from PubChem (CID 137091036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).