3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one

C20H19NO2 — CID 12879399

IUPAC3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one
SMILESCCOc1cccc(-c2cn(C)cc(-c3ccccc3)c2=O)c1
InChIInChI=1S/C20H19NO2/c1-3-23-17-11-7-10-16(12-17)19-14-21(2)13-18(20(19)22)15-8-5-4-6-9-15/h4-14H,3H2,1-2H3
InChIKeyFNQAFOVJGCHDEM-UHFFFAOYSA-N
MW305.38 g/mol
LogP4.12
Rot. Bonds4

About 3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one

3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one (PubChem CID 12879399) has the molecular formula C20H19NO2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one.

Molecular Properties

Compound Name3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one
PubChem CID12879399
Molecular FormulaC20H19NO2
Molecular Weight305.38 g/mol
Exact Mass305.14
IUPAC Name3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one
SMILESCCOc1cccc(-c2cn(C)cc(-c3ccccc3)c2=O)c1
InChIInChI=1S/C20H19NO2/c1-3-23-17-11-7-10-16(12-17)19-14-21(2)13-18(20(19)22)15-8-5-4-6-9-15/h4-14H,3H2,1-2H3
InChIKeyFNQAFOVJGCHDEM-UHFFFAOYSA-N
XLogP4.12
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-methyl-3-(3-octoxyphenyl)-5-phenylpyridin-4-one
CID 21320696
3-(3-hexoxyphenyl)-1-methyl-5-phenylpyridin-4-one
CID 23276833
3-[3-[(Z)-1-fluoro-2-iodoethenoxy]phenyl]-1-methyl-5-phenylpyridin-4-one
CID 21320916
CID 88533014
CID 88533014
2-(3-ethoxyphenyl)aniline
CID 57482711
3-(3-ethoxyphenyl)-1H-pyridin-2-one
CID 53217766
1-ethenyl-2-(3-ethoxyphenyl)benzene
CID 151818646
3-(3-ethoxyphenyl)-2-methylbenzoic acid
CID 53226301
2,4-diethoxy-1-phenylbenzene
CID 132889855
4-ethoxy-1-iodo-2-phenylbenzene
CID 156900261
1-methyl-3-phenyl-5-[3-(3-propan-2-ylphenyl)sulfanylphenyl]pyridin-4-one
CID 23328511
4-ethoxy-2-nitro-1-phenylbenzene
CID 165358913

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one?
The IUPAC name of 3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one (CID 12879399) is 3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one.
What is the SMILES notation for 3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one?
The canonical SMILES for 3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one is CCOc1cccc(-c2cn(C)cc(-c3ccccc3)c2=O)c1.
What is the InChIKey of 3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one?
The InChIKey is FNQAFOVJGCHDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO2/c1-3-23-17-11-7-10-16(12-17)19-14-21(2)13-18(20(19)22)15-8-5-4-6-9-15/h4-14H,3H2,1-2H3.
What are the key properties of 3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one?
3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one has a molecular weight of 305.38 g/mol, XLogP of 4.12, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethoxyphenyl)-1-methyl-5-phenylpyridin-4-one is sourced from PubChem (CID 12879399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).