N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide

C19H24N2O4S — CID 1102427

IUPACN-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide
SMILESCCOc1ccc(N(CC(=O)N(C)Cc2ccccc2)S(C)(=O)=O)cc1
InChIInChI=1S/C19H24N2O4S/c1-4-25-18-12-10-17(11-13-18)21(26(3,23)24)15-19(22)20(2)14-16-8-6-5-7-9-16/h5-13H,4,14-15H2,1-3H3
InChIKeyDUAPKTOZXOULCZ-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.51
Rot. Bonds8

About N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide

N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide (PubChem CID 1102427) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide.

Molecular Properties

Compound NameN-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide
PubChem CID1102427
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide
SMILESCCOc1ccc(N(CC(=O)N(C)Cc2ccccc2)S(C)(=O)=O)cc1
InChIInChI=1S/C19H24N2O4S/c1-4-25-18-12-10-17(11-13-18)21(26(3,23)24)15-19(22)20(2)14-16-8-6-5-7-9-16/h5-13H,4,14-15H2,1-3H3
InChIKeyDUAPKTOZXOULCZ-UHFFFAOYSA-N
XLogP2.51
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzyl-2-(4-chloro-N-methylsulfonylanilino)-N-methylacetamide
CID 30168789
2-[benzyl-[2-(4-ethoxy-N-methylsulfonylanilino)acetyl]amino]-N-methylpropanamide
CID 132674229
2-[benzyl-[2-(4-ethoxy-N-methylsulfonylanilino)acetyl]amino]-N-methylbutanamide
CID 132676225
2-[benzyl-[2-(4-ethoxy-N-methylsulfonylanilino)acetyl]amino]-N-tert-butylpropanamide
CID 132987057
2-[N-(benzenesulfonyl)-4-ethoxyanilino]-N,N-dibenzylacetamide
CID 30169640
N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylbutanamide
CID 132662390
(2R)-2-[benzyl-[2-(4-ethoxy-N-methylsulfonylanilino)acetyl]amino]-N-butyl-3-phenylpropanamide
CID 100581489
N-benzyl-2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-methylacetamide
CID 1098087
N-benzyl-2-(3-bromo-N-methylsulfonylanilino)-N-methylacetamide
CID 1095173
N-benzyl-2-(3-chloro-N-methylsulfonylanilino)-N-methylacetamide
CID 1203987
N,N-dibenzyl-2-(N-methylsulfonyl-4-propan-2-yloxyanilino)acetamide
CID 30257661
N-benzyl-N-methyl-2-[methyl(methylsulfonyl)amino]acetamide
CID 30464576

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide?
The IUPAC name of N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide (CID 1102427) is N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide.
What is the SMILES notation for N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide?
The canonical SMILES for N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide is CCOc1ccc(N(CC(=O)N(C)Cc2ccccc2)S(C)(=O)=O)cc1.
What is the InChIKey of N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide?
The InChIKey is DUAPKTOZXOULCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-4-25-18-12-10-17(11-13-18)21(26(3,23)24)15-19(22)20(2)14-16-8-6-5-7-9-16/h5-13H,4,14-15H2,1-3H3.
What are the key properties of N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide?
N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide has a molecular weight of 376.48 g/mol, XLogP of 2.51, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(4-ethoxy-N-methylsulfonylanilino)-N-methylacetamide is sourced from PubChem (CID 1102427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).