2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol

C23H20N2O3 — CID 70186747

IUPAC2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol
SMILESCOc1ccc(O)c(C2(c3ccccc3O)C=CC=C(c3ccccn3)N2)c1
InChIInChI=1S/C23H20N2O3/c1-28-16-11-12-22(27)18(15-16)23(17-7-2-3-10-21(17)26)13-6-9-20(25-23)19-8-4-5-14-24-19/h2-15,25-27H,1H3
InChIKeyLWYPGMFJKAZAOA-UHFFFAOYSA-N
MW372.42 g/mol
LogP3.95
Rot. Bonds4

About 2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol

2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol (PubChem CID 70186747) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol.

Molecular Properties

Compound Name2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol
PubChem CID70186747
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol
SMILESCOc1ccc(O)c(C2(c3ccccc3O)C=CC=C(c3ccccn3)N2)c1
InChIInChI=1S/C23H20N2O3/c1-28-16-11-12-22(27)18(15-16)23(17-7-2-3-10-21(17)26)13-6-9-20(25-23)19-8-4-5-14-24-19/h2-15,25-27H,1H3
InChIKeyLWYPGMFJKAZAOA-UHFFFAOYSA-N
XLogP3.95
TPSA74.61 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 53.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol?
The IUPAC name of 2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol (CID 70186747) is 2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol.
What is the SMILES notation for 2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol?
The canonical SMILES for 2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol is COc1ccc(O)c(C2(c3ccccc3O)C=CC=C(c3ccccn3)N2)c1.
What is the InChIKey of 2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol?
The InChIKey is LWYPGMFJKAZAOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c1-28-16-11-12-22(27)18(15-16)23(17-7-2-3-10-21(17)26)13-6-9-20(25-23)19-8-4-5-14-24-19/h2-15,25-27H,1H3.
What are the key properties of 2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol?
2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol has a molecular weight of 372.42 g/mol, XLogP of 3.95, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol is sourced from PubChem (CID 70186747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).