3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide

C17H28N4O4S — CID 109063961

IUPAC3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide
SMILESCN(C)CCNS(=O)(=O)c1cccc(C(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C17H28N4O4S/c1-20(2)8-7-19-26(23,24)16-5-3-4-15(14-16)17(22)18-6-9-21-10-12-25-13-11-21/h3-5,14,19H,6-13H2,1-2H3,(H,18,22)
InChIKeyAZQIYDYMTBCKHD-UHFFFAOYSA-N
MW384.50 g/mol
LogP-0.41
Rot. Bonds9

About 3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide

3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide (PubChem CID 109063961) has the molecular formula C17H28N4O4S and a molecular weight of 384.50 g/mol. Its IUPAC name is 3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide.

Molecular Properties

Compound Name3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide
PubChem CID109063961
Molecular FormulaC17H28N4O4S
Molecular Weight384.50 g/mol
Exact Mass384.18
IUPAC Name3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide
SMILESCN(C)CCNS(=O)(=O)c1cccc(C(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C17H28N4O4S/c1-20(2)8-7-19-26(23,24)16-5-3-4-15(14-16)17(22)18-6-9-21-10-12-25-13-11-21/h3-5,14,19H,6-13H2,1-2H3,(H,18,22)
InChIKeyAZQIYDYMTBCKHD-UHFFFAOYSA-N
XLogP-0.41
TPSA90.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.50
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-(cyclopropylmethylsulfamoyl)-N-(2-morpholin-4-ylethyl)benzamide
CID 47039154
N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide
CID 50945849
N-[3-(dimethylamino)propyl]-3-(morpholine-4-carbonyl)benzenesulfonamide
CID 110677143
3-bromo-N-(2-morpholin-4-ylethyl)benzamide
CID 669309
3-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-[2-(dimethylamino)ethyl]benzamide
CID 109063514
3-[(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)benzamide
CID 4157842
3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide
CID 100786193
3-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 669179
3-(methoxymethyl)-N-(2-morpholin-4-ylethyl)benzamide
CID 51218992
N-(3-morpholin-4-ylpropyl)-3-pyrrolidin-1-ylsulfonylbenzamide
CID 2329278
N-[2-(dimethylamino)ethyl]-3-(4-ethylpiperazine-1-carbonyl)benzenesulfonamide
CID 109063964
3-[2-(dimethylamino)ethylsulfamoyl]-N-(pyridin-4-ylmethyl)benzamide
CID 109063983

Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide?
The IUPAC name of 3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide (CID 109063961) is 3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide.
What is the SMILES notation for 3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide?
The canonical SMILES for 3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide is CN(C)CCNS(=O)(=O)c1cccc(C(=O)NCCN2CCOCC2)c1.
What is the InChIKey of 3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide?
The InChIKey is AZQIYDYMTBCKHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O4S/c1-20(2)8-7-19-26(23,24)16-5-3-4-15(14-16)17(22)18-6-9-21-10-12-25-13-11-21/h3-5,14,19H,6-13H2,1-2H3,(H,18,22).
What are the key properties of 3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide?
3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide has a molecular weight of 384.50 g/mol, XLogP of -0.41, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)ethylsulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide is sourced from PubChem (CID 109063961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).