N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide

C24H27N3O4S2 — CID 43057595

IUPACN-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide
SMILESO=C(NCC(c1ccccc1)N1CCOCC1)c1cccc(S(=O)(=O)NCc2cccs2)c1
InChIInChI=1S/C24H27N3O4S2/c28-24(25-18-23(19-6-2-1-3-7-19)27-11-13-31-14-12-27)20-8-4-10-22(16-20)33(29,30)26-17-21-9-5-15-32-21/h1-10,15-16,23,26H,11-14,17-18H2,(H,25,28)
InChIKeyCTJWSGDKDSNJMZ-UHFFFAOYSA-N
MW485.63 g/mol
LogP3.03
Rot. Bonds9

About N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide

N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide (PubChem CID 43057595) has the molecular formula C24H27N3O4S2 and a molecular weight of 485.63 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide
PubChem CID43057595
Molecular FormulaC24H27N3O4S2
Molecular Weight485.63 g/mol
Exact Mass485.14
IUPAC NameN-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide
SMILESO=C(NCC(c1ccccc1)N1CCOCC1)c1cccc(S(=O)(=O)NCc2cccs2)c1
InChIInChI=1S/C24H27N3O4S2/c28-24(25-18-23(19-6-2-1-3-7-19)27-11-13-31-14-12-27)20-8-4-10-22(16-20)33(29,30)26-17-21-9-5-15-32-21/h1-10,15-16,23,26H,11-14,17-18H2,(H,25,28)
InChIKeyCTJWSGDKDSNJMZ-UHFFFAOYSA-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

3-(benzylsulfamoyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
CID 2315122
N-(2-morpholin-4-yl-2-phenylethyl)-4-(2-thiophen-2-ylethylsulfamoyl)benzamide
CID 43060346
N-[2-(dimethylamino)-2-phenylethyl]-3-(thiophen-2-ylmethylsulfamoyl)benzamide
CID 43016489
3-(ethylsulfamoyl)-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide
CID 55462512
3-(dimethylsulfamoyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 4501315
N-[2-(methylamino)propyl]-3-(thiophen-2-ylmethylsulfamoyl)benzamide;hydrochloride
CID 120829635
3-amino-N-(2-morpholin-4-yl-2-phenylethyl)benzamide;dihydrochloride
CID 119853244
N-(2-phenylsulfanylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide
CID 26444819
3-(benzylsulfamoyl)-N-(2-thiophen-2-ylethyl)benzamide
CID 27770474
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-3-[[3-(trifluoromethyl)phenyl]sulfamoyl]benzamide
CID 4113188
3-fluoro-N-(2-morpholin-4-yl-2-phenylethyl)benzenesulfonamide
CID 47023210
N-[2-(methylamino)ethyl]-3-(thiophen-2-ylmethylsulfamoyl)benzamide;hydrochloride
CID 119499971

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide?
The IUPAC name of N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide (CID 43057595) is N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide is O=C(NCC(c1ccccc1)N1CCOCC1)c1cccc(S(=O)(=O)NCc2cccs2)c1.
What is the InChIKey of N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide?
The InChIKey is CTJWSGDKDSNJMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O4S2/c28-24(25-18-23(19-6-2-1-3-7-19)27-11-13-31-14-12-27)20-8-4-10-22(16-20)33(29,30)26-17-21-9-5-15-32-21/h1-10,15-16,23,26H,11-14,17-18H2,(H,25,28).
What are the key properties of N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide?
N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)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 N-(2-morpholin-4-yl-2-phenylethyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide is sourced from PubChem (CID 43057595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).