1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one

C16H20N2O2 — CID 82420006

IUPAC1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one
SMILESCCOc1ccc(-n2cc(CNC)c(=O)cc2C)cc1
InChIInChI=1S/C16H20N2O2/c1-4-20-15-7-5-14(6-8-15)18-11-13(10-17-3)16(19)9-12(18)2/h5-9,11,17H,4,10H2,1-3H3
InChIKeyKDGFECMWBLLVLY-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.26
Rot. Bonds5

About 1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one

1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one (PubChem CID 82420006) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one
PubChem CID82420006
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one
SMILESCCOc1ccc(-n2cc(CNC)c(=O)cc2C)cc1
InChIInChI=1S/C16H20N2O2/c1-4-20-15-7-5-14(6-8-15)18-11-13(10-17-3)16(19)9-12(18)2/h5-9,11,17H,4,10H2,1-3H3
InChIKeyKDGFECMWBLLVLY-UHFFFAOYSA-N
XLogP2.26
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-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-(4-ethoxyphenyl)-5-(ethylaminomethyl)-2-methylpyridin-4-one
CID 82420007
5-acetyl-1-(4-ethoxyphenyl)-2-methylpyridin-4-one
CID 82420020
1-(2,4-dimethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one
CID 82422073
5-(ethylaminomethyl)-2-methyl-1-phenylpyridin-4-one
CID 82419741
1-(4-ethylphenyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-one
CID 82421084
1-[4-(4-ethoxyphenoxy)-2-methylphenyl]-N-methylmethanamine
CID 62128798
1-[1-(4-ethoxyphenyl)imidazol-4-yl]-N-methylmethanamine
CID 114203964
1-(4-fluorophenyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-one
CID 82421850
5-(butylaminomethyl)-1-(3,4-dimethylphenyl)-2-methylpyridin-4-one
CID 82421165
5-(chloromethyl)-1-(4-fluorophenyl)-2-methylpyridin-4-one
CID 82421856
1-(2,5-dimethoxyphenyl)-5-(ethylaminomethyl)-2-methylpyridin-4-one
CID 82420708
6-(4-ethoxyphenyl)-2-methyl-4-(methylaminomethyl)pyridazin-3-one
CID 82444331

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one?
The IUPAC name of 1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one (CID 82420006) is 1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one.
What is the SMILES notation for 1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one?
The canonical SMILES for 1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one is CCOc1ccc(-n2cc(CNC)c(=O)cc2C)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one?
The InChIKey is KDGFECMWBLLVLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-4-20-15-7-5-14(6-8-15)18-11-13(10-17-3)16(19)9-12(18)2/h5-9,11,17H,4,10H2,1-3H3.
What are the key properties of 1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one?
1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one has a molecular weight of 272.35 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one is sourced from PubChem (CID 82420006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).