N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide

C19H24N2O3S — CID 55905207

IUPACN-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide
SMILESCCNC(=O)c1ccc(CNS(=O)(=O)c2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C19H24N2O3S/c1-5-20-19(22)17-8-6-16(7-9-17)12-21-25(23,24)18-14(3)10-13(2)11-15(18)4/h6-11,21H,5,12H2,1-4H3,(H,20,22)
InChIKeyCHLBQULSBFIATB-UHFFFAOYSA-N
MW360.48 g/mol
LogP2.84
Rot. Bonds6

About N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide

N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide (PubChem CID 55905207) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide.

Molecular Properties

Compound NameN-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide
PubChem CID55905207
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide
SMILESCCNC(=O)c1ccc(CNS(=O)(=O)c2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C19H24N2O3S/c1-5-20-19(22)17-8-6-16(7-9-17)12-21-25(23,24)18-14(3)10-13(2)11-15(18)4/h6-11,21H,5,12H2,1-4H3,(H,20,22)
InChIKeyCHLBQULSBFIATB-UHFFFAOYSA-N
XLogP2.84
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-4-[[(4-sulfamoylphenyl)sulfonylamino]methyl]benzamide
CID 55904950
dimethyl-[[4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]phenyl]methyl]azanium
CID 9191357
N-[(4-methoxyphenyl)methyl]-2,4,6-trimethylbenzenesulfonamide
CID 668979
4-[[(2,4-dibromophenyl)sulfonylamino]methyl]-N-ethylbenzamide
CID 55906367
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-4-methyl-3-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide
CID 31544756
methyl 3-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzoate
CID 134944324
N-ethyl-4-[1-methyl-5-[(2,4,6-trimethylphenyl)sulfonylamino]benzimidazol-2-yl]benzamide
CID 50825657
4-[[(2,3,5,6-tetramethylphenyl)sulfonylamino]methyl]benzoic acid
CID 852335
2,4,6-trimethyl-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]benzenesulfonamide
CID 47015636
4-[[(4-cyclohexylphenyl)sulfonylamino]methyl]-N-ethylbenzamide
CID 52708157
4-(acetamidomethyl)-N-ethylbenzamide
CID 20648409
4-[[(2,3,5,6-tetramethylphenyl)sulfonylamino]methyl]benzoate
CID 4157565

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide?
The IUPAC name of N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide (CID 55905207) is N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide.
What is the SMILES notation for N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide?
The canonical SMILES for N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide is CCNC(=O)c1ccc(CNS(=O)(=O)c2c(C)cc(C)cc2C)cc1.
What is the InChIKey of N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide?
The InChIKey is CHLBQULSBFIATB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-5-20-19(22)17-8-6-16(7-9-17)12-21-25(23,24)18-14(3)10-13(2)11-15(18)4/h6-11,21H,5,12H2,1-4H3,(H,20,22).
What are the key properties of N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide?
N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide has a molecular weight of 360.48 g/mol, XLogP of 2.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzamide is sourced from PubChem (CID 55905207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).