N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide

C17H20N2O3S — CID 9117954

IUPACN-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide
SMILESCCN(CC(=O)Nc1ccc(OC)cc1)C(=O)Cc1cccs1
InChIInChI=1S/C17H20N2O3S/c1-3-19(17(21)11-15-5-4-10-23-15)12-16(20)18-13-6-8-14(22-2)9-7-13/h4-10H,3,11-12H2,1-2H3,(H,18,20)
InChIKeyJPMGNTRFTNCPAG-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.79
Rot. Bonds7

About N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide

N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide (PubChem CID 9117954) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide
PubChem CID9117954
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC NameN-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide
SMILESCCN(CC(=O)Nc1ccc(OC)cc1)C(=O)Cc1cccs1
InChIInChI=1S/C17H20N2O3S/c1-3-19(17(21)11-15-5-4-10-23-15)12-16(20)18-13-6-8-14(22-2)9-7-13/h4-10H,3,11-12H2,1-2H3,(H,18,20)
InChIKeyJPMGNTRFTNCPAG-UHFFFAOYSA-N
XLogP2.79
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-Methoxyphenyl)-2-thiophenecarboxamide
CID 573876
ethyl 2-((2-(2,4-dimethoxy-N-prop-2-ynoylanilino)-2-thiophen-2-ylacetyl)amino)acetate
CID 66555902
Thiophene-2-carboxylic acid {4-[4-(2-methoxy-phenyl)-piperazin-1-yl]-butyl}-amide
CID 10248783
5-(4-Methoxyanilino)-3-methyl-1,3-thiazolidine-2,4-dione
CID 3155776
Pyrrolidine-1,2-dicarboxylic acid 1-[(2-methoxy-phenyl)-amide] 2-[(thiophen-2-ylmethyl)-amide]
CID 3219706
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide
CID 4045486
N-[2-(dimethylamino)ethyl]-N'-(4-methoxyphenyl)-N-(thien-2-ylmethyl)thiourea
CID 4598535
N-(3-chloro-4-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide
CID 8965468
N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-2-thiophen-3-ylacetamide
CID 9438703
N-(4-Ethoxy-phenyl)-3-[(2-thiophen-2-yl-acetyl)-hydrazono]-butyramide
CID 9594049
(2S)-N-[2-(3-methoxyanilino)-2-oxoethyl]-N-methyl-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
CID 16247900
1-(4-Methoxyphenyl)-3-[(thiophen-2-ylmethyl)amino]pyrrolidine-2,5-dione
CID 661792

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide (CID 9117954) is N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide is CCN(CC(=O)Nc1ccc(OC)cc1)C(=O)Cc1cccs1.
What is the InChIKey of N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
The InChIKey is JPMGNTRFTNCPAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-3-19(17(21)11-15-5-4-10-23-15)12-16(20)18-13-6-8-14(22-2)9-7-13/h4-10H,3,11-12H2,1-2H3,(H,18,20).
What are the key properties of N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide has a molecular weight of 332.43 g/mol, XLogP of 2.79, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 9117954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).