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

C18H23N3O4S2 — CID 24982564

IUPAC3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
SMILESCNS(=O)(=O)c1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1
InChIInChI=1S/C18H23N3O4S2/c1-19-27(23,24)15-5-2-4-14(12-15)18(22)20-13-16(17-6-3-11-26-17)21-7-9-25-10-8-21/h2-6,11-12,16,19H,7-10,13H2,1H3,(H,20,22)
InChIKeyIZFIENLRBWMUII-UHFFFAOYSA-N
MW409.53 g/mol
LogP1.46
Rot. Bonds7

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

3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide (PubChem CID 24982564) has the molecular formula C18H23N3O4S2 and a molecular weight of 409.53 g/mol. Its IUPAC name is 3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide.

Molecular Properties

Compound Name3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
PubChem CID24982564
Molecular FormulaC18H23N3O4S2
Molecular Weight409.53 g/mol
Exact Mass409.11
IUPAC Name3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
SMILESCNS(=O)(=O)c1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1
InChIInChI=1S/C18H23N3O4S2/c1-19-27(23,24)15-5-2-4-14(12-15)18(22)20-13-16(17-6-3-11-26-17)21-7-9-25-10-8-21/h2-6,11-12,16,19H,7-10,13H2,1H3,(H,20,22)
InChIKeyIZFIENLRBWMUII-UHFFFAOYSA-N
XLogP1.46
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.53
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The IUPAC name of 3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide (CID 24982564) is 3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide.
What is the SMILES notation for 3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The canonical SMILES for 3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide is CNS(=O)(=O)c1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1.
What is the InChIKey of 3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The InChIKey is IZFIENLRBWMUII-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O4S2/c1-19-27(23,24)15-5-2-4-14(12-15)18(22)20-13-16(17-6-3-11-26-17)21-7-9-25-10-8-21/h2-6,11-12,16,19H,7-10,13H2,1H3,(H,20,22).
What are the key properties of 3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide has a molecular weight of 409.53 g/mol, XLogP of 1.46, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide is sourced from PubChem (CID 24982564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).