N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide

C17H20N4O4S — CID 108989678

IUPACN-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1
InChIInChI=1S/C17H20N4O4S/c1-12(22)20-14-4-6-15(7-5-14)21-17(23)19-11-10-13-2-8-16(9-3-13)26(18,24)25/h2-9H,10-11H2,1H3,(H,20,22)(H2,18,24,25)(H2,19,21,23)
InChIKeyNQBWUVOTSSOEJE-UHFFFAOYSA-N
MW376.44 g/mol
LogP1.66
Rot. Bonds6

About N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide

N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide (PubChem CID 108989678) has the molecular formula C17H20N4O4S and a molecular weight of 376.44 g/mol. Its IUPAC name is N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide
PubChem CID108989678
Molecular FormulaC17H20N4O4S
Molecular Weight376.44 g/mol
Exact Mass376.12
IUPAC NameN-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1
InChIInChI=1S/C17H20N4O4S/c1-12(22)20-14-4-6-15(7-5-14)21-17(23)19-11-10-13-2-8-16(9-3-13)26(18,24)25/h2-9H,10-11H2,1H3,(H,20,22)(H2,18,24,25)(H2,19,21,23)
InChIKeyNQBWUVOTSSOEJE-UHFFFAOYSA-N
XLogP1.66
TPSA130.39 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.44
LogP ≤ 51.66
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide 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

1-(4-chlorophenyl)-3-[2-(4-sulfamoylphenyl)ethyl]urea
CID 1130083
1-(4-ethoxyphenyl)-3-[2-(4-sulfamoylphenyl)ethyl]urea
CID 25040507
1-(4-propan-2-yloxyphenyl)-3-[2-(4-sulfamoylphenyl)ethyl]urea
CID 51116713
1-(4-chloro-3-fluorophenyl)-3-[2-(4-sulfamoylphenyl)ethyl]urea
CID 51116721
1-phenyl-3-[3-(4-sulfamoylphenyl)propyl]urea
CID 110293756
1-(3-chlorophenyl)-3-[2-(4-sulfamoylphenyl)ethyl]urea
CID 1203825
1-(3-methylsulfanylphenyl)-3-[2-(4-sulfamoylphenyl)ethyl]urea
CID 25041397
1-[2-(4-chlorophenyl)ethyl]-3-(4-sulfamoylphenyl)thiourea
CID 1213468
1-(4-bromophenyl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea
CID 25040998
1-(2,6-dichlorophenyl)-3-[2-(4-sulfamoylphenyl)ethyl]urea
CID 108989685
N-(4-ethylphenyl)-3-[2-(4-sulfamoylphenyl)ethylamino]propanamide
CID 109027692
4-[2-(4-methoxyphenyl)ethylcarbamoylamino]benzenesulfonic acid
CID 108901850

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide?
The IUPAC name of N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide (CID 108989678) is N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide?
The canonical SMILES for N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide is CC(=O)Nc1ccc(NC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1.
What is the InChIKey of N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide?
The InChIKey is NQBWUVOTSSOEJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O4S/c1-12(22)20-14-4-6-15(7-5-14)21-17(23)19-11-10-13-2-8-16(9-3-13)26(18,24)25/h2-9H,10-11H2,1H3,(H,20,22)(H2,18,24,25)(H2,19,21,23).
What are the key properties of N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide?
N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide has a molecular weight of 376.44 g/mol, XLogP of 1.66, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-sulfamoylphenyl)ethylcarbamoylamino]phenyl]acetamide is sourced from PubChem (CID 108989678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).