3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide

C15H23N3O4S — CID 100786193

IUPAC3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide
SMILESCCS(=O)(=O)Nc1cccc(C(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C15H23N3O4S/c1-2-23(20,21)17-14-5-3-4-13(12-14)15(19)16-6-7-18-8-10-22-11-9-18/h3-5,12,17H,2,6-11H2,1H3,(H,16,19)
InChIKeySPSUTBPFGSEJRA-UHFFFAOYSA-N
MW341.43 g/mol
LogP0.51
Rot. Bonds7

About 3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide

3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide (PubChem CID 100786193) has the molecular formula C15H23N3O4S and a molecular weight of 341.43 g/mol. Its IUPAC name is 3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide.

Molecular Properties

Compound Name3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide
PubChem CID100786193
Molecular FormulaC15H23N3O4S
Molecular Weight341.43 g/mol
Exact Mass341.14
IUPAC Name3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide
SMILESCCS(=O)(=O)Nc1cccc(C(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C15H23N3O4S/c1-2-23(20,21)17-14-5-3-4-13(12-14)15(19)16-6-7-18-8-10-22-11-9-18/h3-5,12,17H,2,6-11H2,1H3,(H,16,19)
InChIKeySPSUTBPFGSEJRA-UHFFFAOYSA-N
XLogP0.51
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)benzamide
CID 4157842
3-bromo-N-(2-morpholin-4-ylethyl)benzamide
CID 669309
3-N-(3-acetylphenyl)-1-N-(2-morpholin-4-ylethyl)benzene-1,3-dicarboxamide
CID 109053343
3-(2-methylpropanoylamino)-N-(2-morpholin-4-ylethyl)benzamide
CID 4051447
3-acetamido-N-(3-morpholin-4-ylpropyl)benzamide
CID 51162231
3-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 669179
N-[3-(4-ethylpiperazin-1-yl)propyl]-3-(propylsulfonylamino)benzamide
CID 55660410
3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-(3-morpholin-4-ylpropyl)benzamide
CID 24687436
3-(methoxymethyl)-N-(2-morpholin-4-ylethyl)benzamide
CID 51218992
3-hydroxy-N-(3-morpholin-4-ylpropyl)benzamide
CID 43236314
N-(3-piperazin-1-ylpropyl)-3-(propylsulfonylamino)benzamide;hydrochloride
CID 119393786
N-[3-(4-ethylpiperazin-1-yl)propyl]-3-(methanesulfonamido)benzamide
CID 55660415

Frequently Asked Questions

What is the IUPAC name of 3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide?
The IUPAC name of 3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide (CID 100786193) is 3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide.
What is the SMILES notation for 3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide?
The canonical SMILES for 3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide is CCS(=O)(=O)Nc1cccc(C(=O)NCCN2CCOCC2)c1.
What is the InChIKey of 3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide?
The InChIKey is SPSUTBPFGSEJRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O4S/c1-2-23(20,21)17-14-5-3-4-13(12-14)15(19)16-6-7-18-8-10-22-11-9-18/h3-5,12,17H,2,6-11H2,1H3,(H,16,19).
What are the key properties of 3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide?
3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide has a molecular weight of 341.43 g/mol, XLogP of 0.51, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylsulfonylamino)-N-(2-morpholin-4-ylethyl)benzamide is sourced from PubChem (CID 100786193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).