4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide

C16H25N3O4S — CID 109058127

IUPAC4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccc(S(=O)(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C16H25N3O4S/c1-13(2)18-16(20)14-3-5-15(6-4-14)24(21,22)17-7-8-19-9-11-23-12-10-19/h3-6,13,17H,7-12H2,1-2H3,(H,18,20)
InChIKeyRZHDRANSTKROTL-UHFFFAOYSA-N
MW355.46 g/mol
LogP0.44
Rot. Bonds7

About 4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide

4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide (PubChem CID 109058127) has the molecular formula C16H25N3O4S and a molecular weight of 355.46 g/mol. Its IUPAC name is 4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide
PubChem CID109058127
Molecular FormulaC16H25N3O4S
Molecular Weight355.46 g/mol
Exact Mass355.16
IUPAC Name4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccc(S(=O)(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C16H25N3O4S/c1-13(2)18-16(20)14-3-5-15(6-4-14)24(21,22)17-7-8-19-9-11-23-12-10-19/h3-6,13,17H,7-12H2,1-2H3,(H,18,20)
InChIKeyRZHDRANSTKROTL-UHFFFAOYSA-N
XLogP0.44
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.46
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyethyl)-4-(2-morpholin-4-ylethylsulfamoyl)benzamide
CID 109059683
4-(1-hydroxyethyl)-N-(2-morpholin-4-ylethyl)benzenesulfonamide
CID 43507444
4-(morpholine-4-carbonyl)-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 128931008
4-tert-butyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide;oxalic acid
CID 56603480
N-(2-morpholin-4-ylethyl)-4-[4-(2-morpholin-4-ylethylsulfamoyl)phenoxy]benzenesulfonamide
CID 2908203
4-[(3,4-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide
CID 22108828
4-hydroxy-N-(3-morpholin-4-ylpropyl)benzenesulfonamide
CID 43348296
4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N-(3-morpholin-4-ylpropyl)benzamide
CID 126479402
N-(2-morpholin-4-ylethyl)-4-sulfamoylbenzamide
CID 25060315
4-(2-bromoethyl)-N-(2-morpholin-4-ylethyl)benzenesulfonamide
CID 110316594
2-hydroxy-5-(2-morpholin-4-ylethylsulfamoyl)benzoic acid
CID 8891748
N-(2-morpholin-4-ylethyl)-4-[(propan-2-ylamino)methyl]benzamide
CID 89495259

Frequently Asked Questions

What is the IUPAC name of 4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide?
The IUPAC name of 4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide (CID 109058127) is 4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide.
What is the SMILES notation for 4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide?
The canonical SMILES for 4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide is CC(C)NC(=O)c1ccc(S(=O)(=O)NCCN2CCOCC2)cc1.
What is the InChIKey of 4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide?
The InChIKey is RZHDRANSTKROTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O4S/c1-13(2)18-16(20)14-3-5-15(6-4-14)24(21,22)17-7-8-19-9-11-23-12-10-19/h3-6,13,17H,7-12H2,1-2H3,(H,18,20).
What are the key properties of 4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide?
4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide has a molecular weight of 355.46 g/mol, XLogP of 0.44, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-morpholin-4-ylethylsulfamoyl)-N-propan-2-ylbenzamide is sourced from PubChem (CID 109058127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).