2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol

C24H20N2O2 — CID 135544149

IUPAC2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol
SMILESCc1ccc(-c2cccc(-c3cccc(-c4ccc(C)cc4O)n3)n2)c(O)c1
InChIInChI=1S/C24H20N2O2/c1-15-9-11-17(23(27)13-15)19-5-3-7-21(25-19)22-8-4-6-20(26-22)18-12-10-16(2)14-24(18)28/h3-14,27-28H,1-2H3
InChIKeyUEQTWFJIPLPQCT-UHFFFAOYSA-N
MW368.44 g/mol
LogP5.51
Rot. Bonds3

About 2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol

2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol (PubChem CID 135544149) has the molecular formula C24H20N2O2 and a molecular weight of 368.44 g/mol. Its IUPAC name is 2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol.

Molecular Properties

Compound Name2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol
PubChem CID135544149
Molecular FormulaC24H20N2O2
Molecular Weight368.44 g/mol
Exact Mass368.15
IUPAC Name2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol
SMILESCc1ccc(-c2cccc(-c3cccc(-c4ccc(C)cc4O)n3)n2)c(O)c1
InChIInChI=1S/C24H20N2O2/c1-15-9-11-17(23(27)13-15)19-5-3-7-21(25-19)22-8-4-6-20(26-22)18-12-10-16(2)14-24(18)28/h3-14,27-28H,1-2H3
InChIKeyUEQTWFJIPLPQCT-UHFFFAOYSA-N
XLogP5.51
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.44
LogP ≤ 55.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol?
The IUPAC name of 2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol (CID 135544149) is 2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol.
What is the SMILES notation for 2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol?
The canonical SMILES for 2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol is Cc1ccc(-c2cccc(-c3cccc(-c4ccc(C)cc4O)n3)n2)c(O)c1.
What is the InChIKey of 2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol?
The InChIKey is UEQTWFJIPLPQCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O2/c1-15-9-11-17(23(27)13-15)19-5-3-7-21(25-19)22-8-4-6-20(26-22)18-12-10-16(2)14-24(18)28/h3-14,27-28H,1-2H3.
What are the key properties of 2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol?
2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol has a molecular weight of 368.44 g/mol, XLogP of 5.51, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[6-(2-hydroxy-4-methylphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol is sourced from PubChem (CID 135544149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).