N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide

C20H26N2O5S — CID 8917809

IUPACN-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide
SMILESCCOc1ccc(OCCCC(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)cc1
InChIInChI=1S/C20H26N2O5S/c1-4-26-17-9-11-18(12-10-17)27-15-5-6-20(23)21-16-7-13-19(14-8-16)28(24,25)22(2)3/h7-14H,4-6,15H2,1-3H3,(H,21,23)
InChIKeySLPOIABVXBRVBD-UHFFFAOYSA-N
MW406.50 g/mol
LogP3.13
Rot. Bonds10

About N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide

N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide (PubChem CID 8917809) has the molecular formula C20H26N2O5S and a molecular weight of 406.50 g/mol. Its IUPAC name is N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide.

Molecular Properties

Compound NameN-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide
PubChem CID8917809
Molecular FormulaC20H26N2O5S
Molecular Weight406.50 g/mol
Exact Mass406.16
IUPAC NameN-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide
SMILESCCOc1ccc(OCCCC(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)cc1
InChIInChI=1S/C20H26N2O5S/c1-4-26-17-9-11-18(12-10-17)27-15-5-6-20(23)21-16-7-13-19(14-8-16)28(24,25)22(2)3/h7-14H,4-6,15H2,1-3H3,(H,21,23)
InChIKeySLPOIABVXBRVBD-UHFFFAOYSA-N
XLogP3.13
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.50
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide 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

2-[4-(dimethylsulfamoyl)phenyl]-N-(4-ethoxyphenyl)acetamide
CID 110674552
N-[4-(dimethylsulfamoyl)phenyl]-4-ethoxybenzamide
CID 2672905
4-(4-methoxyphenoxy)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]butanamide
CID 9219938
N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]-4-(4-methylphenoxy)butanamide
CID 21173979
N,N'-bis(4-ethoxyphenyl)nonanediamide
CID 4507995
N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide
CID 7732574
3-(4-chlorophenoxy)-N-[4-(diethylsulfamoyl)phenyl]propanamide
CID 108802951
N-[3-(dimethylsulfamoylmethyl)phenyl]-4-(4-ethoxyphenoxy)butanamide
CID 171138767
[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl] 3-phenoxypropanoate
CID 7841332
2-(4-chlorophenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 2710578
4-(4-ethylphenoxy)-N-(4-ethylphenyl)butanamide
CID 19173503
4-[2-[6-[2-[4-(4-ethoxyanilino)-4-oxobutanoyl]hydrazinyl]-6-oxohexanoyl]hydrazinyl]-N-(4-ethoxyphenyl)-4-oxobutanamide
CID 5119959

Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide?
The IUPAC name of N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide (CID 8917809) is N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide.
What is the SMILES notation for N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide?
The canonical SMILES for N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide is CCOc1ccc(OCCCC(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)cc1.
What is the InChIKey of N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide?
The InChIKey is SLPOIABVXBRVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O5S/c1-4-26-17-9-11-18(12-10-17)27-15-5-6-20(23)21-16-7-13-19(14-8-16)28(24,25)22(2)3/h7-14H,4-6,15H2,1-3H3,(H,21,23).
What are the key properties of N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide?
N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide has a molecular weight of 406.50 g/mol, XLogP of 3.13, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylsulfamoyl)phenyl]-4-(4-ethoxyphenoxy)butanamide is sourced from PubChem (CID 8917809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).