3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide

C19H25N3O4S2 — CID 4501315

IUPAC3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1
InChIInChI=1S/C19H25N3O4S2/c1-21(2)28(24,25)16-6-3-5-15(13-16)19(23)20-14-17(18-7-4-12-27-18)22-8-10-26-11-9-22/h3-7,12-13,17H,8-11,14H2,1-2H3,(H,20,23)
InChIKeyYCWWNOGRMSOBND-UHFFFAOYSA-N
MW423.56 g/mol
LogP1.80
Rot. Bonds7

About 3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide

3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide (PubChem CID 4501315) has the molecular formula C19H25N3O4S2 and a molecular weight of 423.56 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
PubChem CID4501315
Molecular FormulaC19H25N3O4S2
Molecular Weight423.56 g/mol
Exact Mass423.13
IUPAC Name3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1
InChIInChI=1S/C19H25N3O4S2/c1-21(2)28(24,25)16-6-3-5-15(13-16)19(23)20-14-17(18-7-4-12-27-18)22-8-10-26-11-9-22/h3-7,12-13,17H,8-11,14H2,1-2H3,(H,20,23)
InChIKeyYCWWNOGRMSOBND-UHFFFAOYSA-N
XLogP1.80
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.56
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-3-[phenyl(prop-2-enyl)sulfamoyl]benzamide
CID 24979544
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CID 2315122
3-cyano-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
CID 30335288
3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 18150838
3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride
CID 52984959
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-3-[[3-(trifluoromethyl)phenyl]sulfamoyl]benzamide
CID 4113188
3-(dimethylsulfamoyl)-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]benzamide
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3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
CID 9094127
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)pyridine-4-carboxamide
CID 47007223
N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide
CID 43057595
4-methoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
CID 30335533
2-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 167860438

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide (CID 4501315) is 3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide is CN(C)S(=O)(=O)c1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The InChIKey is YCWWNOGRMSOBND-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O4S2/c1-21(2)28(24,25)16-6-3-5-15(13-16)19(23)20-14-17(18-7-4-12-27-18)22-8-10-26-11-9-22/h3-7,12-13,17H,8-11,14H2,1-2H3,(H,20,23).
What are the key properties of 3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide has a molecular weight of 423.56 g/mol, XLogP of 1.80, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide is sourced from PubChem (CID 4501315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).