3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide

C24H27N3O4S2 — CID 2315122

IUPAC3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
SMILESO=C(NC[C@H](c1cccs1)N1CCOCC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1
InChIInChI=1S/C24H27N3O4S2/c28-24(25-18-22(23-10-5-15-32-23)27-11-13-31-14-12-27)20-8-4-9-21(16-20)33(29,30)26-17-19-6-2-1-3-7-19/h1-10,15-16,22,26H,11-14,17-18H2,(H,25,28)/t22-/m1/s1
InChIKeyFYKOTRYCAGEJSL-JOCHJYFZSA-N
MW485.63 g/mol
LogP3.03
Rot. Bonds9

About 3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide

3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide (PubChem CID 2315122) has the molecular formula C24H27N3O4S2 and a molecular weight of 485.63 g/mol. Its IUPAC name is 3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide.

Molecular Properties

Compound Name3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
PubChem CID2315122
Molecular FormulaC24H27N3O4S2
Molecular Weight485.63 g/mol
Exact Mass485.14
IUPAC Name3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
SMILESO=C(NC[C@H](c1cccs1)N1CCOCC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1
InChIInChI=1S/C24H27N3O4S2/c28-24(25-18-22(23-10-5-15-32-23)27-11-13-31-14-12-27)20-8-4-9-21(16-20)33(29,30)26-17-19-6-2-1-3-7-19/h1-10,15-16,22,26H,11-14,17-18H2,(H,25,28)/t22-/m1/s1
InChIKeyFYKOTRYCAGEJSL-JOCHJYFZSA-N
XLogP3.03
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500485.63
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide
CID 43057595
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CID 4501315
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-3-[[3-(trifluoromethyl)phenyl]sulfamoyl]benzamide
CID 4113188
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-3-[phenyl(prop-2-enyl)sulfamoyl]benzamide
CID 24979544
3-(benzylsulfamoyl)-N-(2-thiophen-2-ylethyl)benzamide
CID 27770474
3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 18150838
3-cyano-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
CID 30335288
3-[(2-fluorophenyl)sulfamoyl]-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)benzamide
CID 24640460
3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride
CID 52984959
3-chloro-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzenesulfonamide
CID 30835865
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-4-phenylmethoxybenzamide
CID 2510532
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)pyridine-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide?
The IUPAC name of 3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide (CID 2315122) is 3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide.
What is the SMILES notation for 3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide?
The canonical SMILES for 3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide is O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1.
What is the InChIKey of 3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide?
The InChIKey is FYKOTRYCAGEJSL-JOCHJYFZSA-N. The full InChI is InChI=1S/C24H27N3O4S2/c28-24(25-18-22(23-10-5-15-32-23)27-11-13-31-14-12-27)20-8-4-9-21(16-20)33(29,30)26-17-19-6-2-1-3-7-19/h1-10,15-16,22,26H,11-14,17-18H2,(H,25,28)/t22-/m1/s1.
What are the key properties of 3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide?
3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide has a molecular weight of 485.63 g/mol, XLogP of 3.03, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide is sourced from PubChem (CID 2315122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).