3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one

C15H20N2O2S — CID 82516590

IUPAC3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one
SMILESCCNCc1ccc(-c2cccs2)n(CCOC)c1=O
InChIInChI=1S/C15H20N2O2S/c1-3-16-11-12-6-7-13(14-5-4-10-20-14)17(15(12)18)8-9-19-2/h4-7,10,16H,3,8-9,11H2,1-2H3
InChIKeyANSZCKYKZVCQTI-UHFFFAOYSA-N
MW292.40 g/mol
LogP2.33
Rot. Bonds7

About 3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one

3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one (PubChem CID 82516590) has the molecular formula C15H20N2O2S and a molecular weight of 292.40 g/mol. Its IUPAC name is 3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one.

Molecular Properties

Compound Name3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one
PubChem CID82516590
Molecular FormulaC15H20N2O2S
Molecular Weight292.40 g/mol
Exact Mass292.12
IUPAC Name3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one
SMILESCCNCc1ccc(-c2cccs2)n(CCOC)c1=O
InChIInChI=1S/C15H20N2O2S/c1-3-16-11-12-6-7-13(14-5-4-10-20-14)17(15(12)18)8-9-19-2/h4-7,10,16H,3,8-9,11H2,1-2H3
InChIKeyANSZCKYKZVCQTI-UHFFFAOYSA-N
XLogP2.33
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(hydroxymethyl)-1-pentyl-6-thiophen-2-ylpyridin-2-one
CID 82516662
1-(3-methoxypropyl)-2-oxo-6-thiophen-2-ylpyridine-3-carbohydrazide
CID 82516554
2-(1-butyl-2-oxo-6-thiophen-2-yl-3-pyridinyl)acetonitrile
CID 82516724
3-acetyl-1-propyl-6-thiophen-2-ylpyridin-2-one
CID 82516774
1-butyl-3-(ethylaminomethyl)-6-phenylpyridin-2-one
CID 82521163
2-ethyl-4-[(2-methoxyethylamino)methyl]-6-thiophen-2-ylpyridazin-3-one
CID 82445319
3-(ethylaminomethyl)-1-(3-methoxypropyl)pyridin-2-one
CID 82526386
1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one
CID 82524808
6-(4-chlorophenyl)-3-(ethylaminomethyl)-1-propylpyridin-2-one
CID 82519302
1-cyclopropyl-3-[(2-methylpropylamino)methyl]-6-thiophen-2-ylpyridin-2-one
CID 82516756
3-(ethylaminomethyl)-6-methyl-1-propylpyridin-2-one
CID 82525370
6-tert-butyl-1-(2-methoxyethyl)-3-[(2-methylpropylamino)methyl]pyridin-2-one
CID 82523492

Frequently Asked Questions

What is the IUPAC name of 3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one?
The IUPAC name of 3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one (CID 82516590) is 3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one.
What is the SMILES notation for 3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one?
The canonical SMILES for 3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one is CCNCc1ccc(-c2cccs2)n(CCOC)c1=O.
What is the InChIKey of 3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one?
The InChIKey is ANSZCKYKZVCQTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2S/c1-3-16-11-12-6-7-13(14-5-4-10-20-14)17(15(12)18)8-9-19-2/h4-7,10,16H,3,8-9,11H2,1-2H3.
What are the key properties of 3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one?
3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one has a molecular weight of 292.40 g/mol, XLogP of 2.33, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylaminomethyl)-1-(2-methoxyethyl)-6-thiophen-2-ylpyridin-2-one is sourced from PubChem (CID 82516590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).