N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide

C17H21N3O4S2 — CID 24981202

IUPACN-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide
SMILESCCN(CC(=O)NCc1cccs1)C(=O)c1cccc(S(=O)(=O)NC)c1
InChIInChI=1S/C17H21N3O4S2/c1-3-20(12-16(21)19-11-14-7-5-9-25-14)17(22)13-6-4-8-15(10-13)26(23,24)18-2/h4-10,18H,3,11-12H2,1-2H3,(H,19,21)
InChIKeyZABUHNLINTUYEZ-UHFFFAOYSA-N
MW395.51 g/mol
LogP1.43
Rot. Bonds8

About N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide

N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide (PubChem CID 24981202) has the molecular formula C17H21N3O4S2 and a molecular weight of 395.51 g/mol. Its IUPAC name is N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide.

Molecular Properties

Compound NameN-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide
PubChem CID24981202
Molecular FormulaC17H21N3O4S2
Molecular Weight395.51 g/mol
Exact Mass395.10
IUPAC NameN-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide
SMILESCCN(CC(=O)NCc1cccs1)C(=O)c1cccc(S(=O)(=O)NC)c1
InChIInChI=1S/C17H21N3O4S2/c1-3-20(12-16(21)19-11-14-7-5-9-25-14)17(22)13-6-4-8-15(10-13)26(23,24)18-2/h4-10,18H,3,11-12H2,1-2H3,(H,19,21)
InChIKeyZABUHNLINTUYEZ-UHFFFAOYSA-N
XLogP1.43
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.51
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-sulfamoylphenyl)methyl]-2-thiophen-2-ylacetamide
CID 694792
1-[(3,4-Dimethylphenyl)sulfonyl]-4-(thien-2-ylcarbonyl)piperazine
CID 1262770
2-[ethyl-(4-propan-2-ylphenyl)sulfonylamino]-N-(thiophen-2-ylmethyl)acetamide
CID 2118296
4-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 24980274
N-[1-(Pyrrolidine-1-carbonyl)-2-thiophen-2-yl-vinyl]-benzamide
CID 2179888
N-[2-(dimethylamino)-2-phenylethyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
CID 4786487
5-methyl-N-[2-oxo-2-(3-phenylpropylamino)ethyl]thiophene-2-carboxamide
CID 4787702
3-(dimethylsulfamoyl)-N-ethyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide
CID 4788844
3-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-ethyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide
CID 4845856
N-(2-{[2-(4-methylphenyl)ethyl]amino}-2-oxoethyl)thiophene-2-carboxamide
CID 5127938
N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-2-phenylacetamide
CID 7809163
[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone
CID 16305983

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide?
The IUPAC name of N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide (CID 24981202) is N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide.
What is the SMILES notation for N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide?
The canonical SMILES for N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide is CCN(CC(=O)NCc1cccs1)C(=O)c1cccc(S(=O)(=O)NC)c1.
What is the InChIKey of N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide?
The InChIKey is ZABUHNLINTUYEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O4S2/c1-3-20(12-16(21)19-11-14-7-5-9-25-14)17(22)13-6-4-8-15(10-13)26(23,24)18-2/h4-10,18H,3,11-12H2,1-2H3,(H,19,21).
What are the key properties of N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide?
N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide has a molecular weight of 395.51 g/mol, XLogP of 1.43, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(methylsulfamoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide is sourced from PubChem (CID 24981202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).