N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide

C19H24N2O4S — CID 110292090

IUPACN-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide
SMILESCCOc1cc(C)c(S(=O)(=O)NCCNC(=O)c2ccccc2)cc1C
InChIInChI=1S/C19H24N2O4S/c1-4-25-17-12-15(3)18(13-14(17)2)26(23,24)21-11-10-20-19(22)16-8-6-5-7-9-16/h5-9,12-13,21H,4,10-11H2,1-3H3,(H,20,22)
InChIKeyXXJAJYBYRALUHG-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.41
Rot. Bonds8

About N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide

N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide (PubChem CID 110292090) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide.

Molecular Properties

Compound NameN-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide
PubChem CID110292090
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide
SMILESCCOc1cc(C)c(S(=O)(=O)NCCNC(=O)c2ccccc2)cc1C
InChIInChI=1S/C19H24N2O4S/c1-4-25-17-12-15(3)18(13-14(17)2)26(23,24)21-11-10-20-19(22)16-8-6-5-7-9-16/h5-9,12-13,21H,4,10-11H2,1-3H3,(H,20,22)
InChIKeyXXJAJYBYRALUHG-UHFFFAOYSA-N
XLogP2.41
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-3,4,5-triethoxybenzamide
CID 46402299
N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide
CID 24663420
N-[2-[(2-methoxy-5-methylphenyl)sulfonylamino]ethyl]benzamide
CID 110292077
4-tert-butyl-N-[2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]ethyl]benzamide
CID 108573220
4-ethoxy-N-(1-hydroxy-3-phenylpropan-2-yl)-2,5-dimethylbenzenesulfonamide
CID 110673589
N-[2-[[2-(trifluoromethoxy)phenyl]sulfonylamino]ethyl]benzamide
CID 31816943
N-[2-[(2,4-dimethylphenyl)sulfonylamino]ethyl]-3,4,5-trimethoxybenzamide
CID 108570759
5-ethoxy-N-(3-hydroxypropyl)-2,4-dimethylbenzenesulfonamide
CID 50876879
4-ethoxy-N,2,5-trimethylbenzenesulfonamide
CID 66485781
N-[2-[(2,4-dimethylphenyl)sulfonylamino]ethyl]-3-hydroxybenzamide
CID 108575024
4-ethoxy-2,5-dimethyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 110712524
2-(4-ethoxyphenyl)-N-[2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]ethyl]acetamide
CID 108573136

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide?
The IUPAC name of N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide (CID 110292090) is N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide.
What is the SMILES notation for N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide?
The canonical SMILES for N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide is CCOc1cc(C)c(S(=O)(=O)NCCNC(=O)c2ccccc2)cc1C.
What is the InChIKey of N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide?
The InChIKey is XXJAJYBYRALUHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-4-25-17-12-15(3)18(13-14(17)2)26(23,24)21-11-10-20-19(22)16-8-6-5-7-9-16/h5-9,12-13,21H,4,10-11H2,1-3H3,(H,20,22).
What are the key properties of N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide?
N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide has a molecular weight of 376.48 g/mol, XLogP of 2.41, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-ethoxy-2,5-dimethylphenyl)sulfonylamino]ethyl]benzamide is sourced from PubChem (CID 110292090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).