N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide

C17H20N2O3S — CID 3837936

IUPACN-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1
InChIInChI=1S/C17H20N2O3S/c1-4-14-5-11-17(12-6-14)23(21,22)18-15-7-9-16(10-8-15)19(3)13(2)20/h5-12,18H,4H2,1-3H3
InChIKeySSEKUNFMGAWPGE-UHFFFAOYSA-N
MW332.43 g/mol
LogP3.03
Rot. Bonds5

About N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide

N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide (PubChem CID 3837936) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide
PubChem CID3837936
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC NameN-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1
InChIInChI=1S/C17H20N2O3S/c1-4-14-5-11-17(12-6-14)23(21,22)18-15-7-9-16(10-8-15)19(3)13(2)20/h5-12,18H,4H2,1-3H3
InChIKeySSEKUNFMGAWPGE-UHFFFAOYSA-N
XLogP3.03
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-methylacetamide
CID 3819698
N-[4-[(4-ethylphenyl)sulfamoyl]phenyl]acetamide
CID 798958
4-ethyl-N-(4-iodophenyl)benzenesulfonamide
CID 1305687
methyl 4-[(4-ethylphenyl)sulfamoyl]benzoate
CID 26487109
N-(4-ethylphenyl)-4-propylbenzenesulfonamide
CID 22773839
4-ethyl-N-[4-[4-[(4-ethylphenyl)sulfonylamino]phenoxy]phenyl]benzenesulfonamide
CID 25047818
4-[(4-ethylphenyl)sulfamoyl]-N,N-dipropylbenzamide
CID 109061565
3-[(4-ethylphenyl)sulfonylamino]-N,N-dimethylbenzamide
CID 24629312
4-(2-chloroethyl)-N-(4-ethylphenyl)benzenesulfonamide
CID 28719478
N-[4-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)phenyl]-N-methylacetamide
CID 86858443
N-[(4-ethylphenyl)methyl]-2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-methylacetamide
CID 30288758
4-ethyl-N-(4-nitrophenyl)benzenesulfonamide
CID 22774107

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide?
The IUPAC name of N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide (CID 3837936) is N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide.
What is the SMILES notation for N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide?
The canonical SMILES for N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide is CCc1ccc(S(=O)(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1.
What is the InChIKey of N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide?
The InChIKey is SSEKUNFMGAWPGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-4-14-5-11-17(12-6-14)23(21,22)18-15-7-9-16(10-8-15)19(3)13(2)20/h5-12,18H,4H2,1-3H3.
What are the key properties of N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide?
N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide has a molecular weight of 332.43 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-ethylphenyl)sulfonylamino]phenyl]-N-methylacetamide is sourced from PubChem (CID 3837936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).