5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one

C18H15NO2 — CID 67418555

IUPAC5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one
SMILESCc1cc(=O)c(O)cn1-c1cccc(-c2ccccc2)c1
InChIInChI=1S/C18H15NO2/c1-13-10-17(20)18(21)12-19(13)16-9-5-8-15(11-16)14-6-3-2-4-7-14/h2-12,21H,1H3
InChIKeyOHKNMOCDRUMSJE-UHFFFAOYSA-N
MW277.32 g/mol
LogP3.52
Rot. Bonds2

About 5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one

5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one (PubChem CID 67418555) has the molecular formula C18H15NO2 and a molecular weight of 277.32 g/mol. Its IUPAC name is 5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one.

Molecular Properties

Compound Name5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one
PubChem CID67418555
Molecular FormulaC18H15NO2
Molecular Weight277.32 g/mol
Exact Mass277.11
IUPAC Name5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one
SMILESCc1cc(=O)c(O)cn1-c1cccc(-c2ccccc2)c1
InChIInChI=1S/C18H15NO2/c1-13-10-17(20)18(21)12-19(13)16-9-5-8-15(11-16)14-6-3-2-4-7-14/h2-12,21H,1H3
InChIKeyOHKNMOCDRUMSJE-UHFFFAOYSA-N
XLogP3.52
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one?
The IUPAC name of 5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one (CID 67418555) is 5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one.
What is the SMILES notation for 5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one?
The canonical SMILES for 5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one is Cc1cc(=O)c(O)cn1-c1cccc(-c2ccccc2)c1.
What is the InChIKey of 5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one?
The InChIKey is OHKNMOCDRUMSJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO2/c1-13-10-17(20)18(21)12-19(13)16-9-5-8-15(11-16)14-6-3-2-4-7-14/h2-12,21H,1H3.
What are the key properties of 5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one?
5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one has a molecular weight of 277.32 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-2-methyl-1-(3-phenylphenyl)pyridin-4-one is sourced from PubChem (CID 67418555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).