3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one

C18H24N2O2 — CID 82518544

IUPAC3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one
SMILESCCNCc1ccc(-c2cccc(OC)c2)n(C(C)C)c1=O
InChIInChI=1S/C18H24N2O2/c1-5-19-12-15-9-10-17(20(13(2)3)18(15)21)14-7-6-8-16(11-14)22-4/h6-11,13,19H,5,12H2,1-4H3
InChIKeyVKSOIPZORWGDCQ-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.21
Rot. Bonds6

About 3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one

3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one (PubChem CID 82518544) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one.

Molecular Properties

Compound Name3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one
PubChem CID82518544
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one
SMILESCCNCc1ccc(-c2cccc(OC)c2)n(C(C)C)c1=O
InChIInChI=1S/C18H24N2O2/c1-5-19-12-15-9-10-17(20(13(2)3)18(15)21)14-7-6-8-16(11-14)22-4/h6-11,13,19H,5,12H2,1-4H3
InChIKeyVKSOIPZORWGDCQ-UHFFFAOYSA-N
XLogP3.21
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-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

6-(3-ethoxyphenyl)-3-(hydroxymethyl)-1-propan-2-ylpyridin-2-one
CID 82518367
methyl 5-(3-methoxyphenyl)-1-propan-2-ylpyrrole-2-carboxylate
CID 117222769
2-[1-ethyl-6-(3-methoxyphenyl)-2-oxo-3-pyridinyl]acetyl chloride
CID 82518551
3-(aminomethyl)-6-(3-methoxyphenyl)-1-methylpyridin-2-one
CID 82189410
2-oxo-1-propan-2-yl-6-(3-propan-2-yloxyphenyl)pyridine-3-carbaldehyde
CID 82518268
3-(1-aminoethyl)-1-ethyl-6-(3-methoxyphenyl)pyridin-2-one
CID 82518553
1-ethyl-3-(methylaminomethyl)-6-(3-propan-2-yloxyphenyl)pyridin-2-one
CID 82518277
1-(1-aminopropan-2-yl)-6-(3-methoxyphenyl)-2-oxopyridine-3-carbonitrile
CID 82146801
2-[1-ethyl-6-(3-methoxyphenyl)-2-oxo-3-pyridinyl]acetonitrile
CID 82518561
methyl 4-(3-methoxyphenyl)-1-propan-2-ylpyrrole-2-carboxylate
CID 117222899
3-[6-(3-methoxyphenyl)-1-methyl-2-oxo-3-pyridinyl]propanoyl chloride
CID 82518575
3-acetyl-1-ethyl-6-(3-methoxyphenyl)pyridin-2-one
CID 82518556

Frequently Asked Questions

What is the IUPAC name of 3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one?
The IUPAC name of 3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one (CID 82518544) is 3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one.
What is the SMILES notation for 3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one?
The canonical SMILES for 3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one is CCNCc1ccc(-c2cccc(OC)c2)n(C(C)C)c1=O.
What is the InChIKey of 3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one?
The InChIKey is VKSOIPZORWGDCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-5-19-12-15-9-10-17(20(13(2)3)18(15)21)14-7-6-8-16(11-14)22-4/h6-11,13,19H,5,12H2,1-4H3.
What are the key properties of 3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one?
3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one has a molecular weight of 300.40 g/mol, XLogP of 3.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylaminomethyl)-6-(3-methoxyphenyl)-1-propan-2-ylpyridin-2-one is sourced from PubChem (CID 82518544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).