N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide

C18H22N2O5S — CID 113061278

IUPACN-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide
SMILESCOc1ccc(N(CCNS(=O)(=O)c2ccccc2)C(C)=O)c(OC)c1
InChIInChI=1S/C18H22N2O5S/c1-14(21)20(17-10-9-15(24-2)13-18(17)25-3)12-11-19-26(22,23)16-7-5-4-6-8-16/h4-10,13,19H,11-12H2,1-3H3
InChIKeyHULWMVSIQXEEBY-UHFFFAOYSA-N
MW378.45 g/mol
LogP2.04
Rot. Bonds8

About N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide

N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide (PubChem CID 113061278) has the molecular formula C18H22N2O5S and a molecular weight of 378.45 g/mol. Its IUPAC name is N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide
PubChem CID113061278
Molecular FormulaC18H22N2O5S
Molecular Weight378.45 g/mol
Exact Mass378.12
IUPAC NameN-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide
SMILESCOc1ccc(N(CCNS(=O)(=O)c2ccccc2)C(C)=O)c(OC)c1
InChIInChI=1S/C18H22N2O5S/c1-14(21)20(17-10-9-15(24-2)13-18(17)25-3)12-11-19-26(22,23)16-7-5-4-6-8-16/h4-10,13,19H,11-12H2,1-3H3
InChIKeyHULWMVSIQXEEBY-UHFFFAOYSA-N
XLogP2.04
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.45
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimethoxyphenyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113061279
N-[2-(N-acetyl-2,4-dimethoxyanilino)ethyl]-2-phenylacetamide
CID 113061243
N-(2,4-dimethoxyphenyl)-N-[2-(phenylcarbamoylamino)ethyl]acetamide
CID 113061264
N-(4-chloro-2-methylphenyl)-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]acetamide
CID 113059951
3-(N-acetyl-2,4-dimethoxyanilino)-N-benzylpropanamide
CID 113130084
N-[2-(N-acetyl-2,4-dimethoxyanilino)ethyl]-3-methylbutanamide
CID 113061222
3-(N-acetyl-2,4-dimethoxyanilino)-N-ethyl-N-phenylpropanamide
CID 113130135
N-[2-[(2-chlorophenyl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide
CID 113060525
N-(3,4-dimethoxyphenyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113061350
N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide
CID 113060704
N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide
CID 113060514
N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-N-methylacetamide
CID 11140694

Frequently Asked Questions

What is the IUPAC name of N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide?
The IUPAC name of N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide (CID 113061278) is N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide.
What is the SMILES notation for N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide?
The canonical SMILES for N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide is COc1ccc(N(CCNS(=O)(=O)c2ccccc2)C(C)=O)c(OC)c1.
What is the InChIKey of N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide?
The InChIKey is HULWMVSIQXEEBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O5S/c1-14(21)20(17-10-9-15(24-2)13-18(17)25-3)12-11-19-26(22,23)16-7-5-4-6-8-16/h4-10,13,19H,11-12H2,1-3H3.
What are the key properties of N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide?
N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide has a molecular weight of 378.45 g/mol, XLogP of 2.04, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide is sourced from PubChem (CID 113061278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).