N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide

C16H18ClN3O3S — CID 109002569

IUPACN-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
SMILESNS(=O)(=O)c1ccc(CCNCC(=O)Nc2ccccc2Cl)cc1
InChIInChI=1S/C16H18ClN3O3S/c17-14-3-1-2-4-15(14)20-16(21)11-19-10-9-12-5-7-13(8-6-12)24(18,22)23/h1-8,19H,9-11H2,(H,20,21)(H2,18,22,23)
InChIKeyPMKGNZKGKKZXJW-UHFFFAOYSA-N
MW367.86 g/mol
LogP1.76
Rot. Bonds7

About N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide

N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide (PubChem CID 109002569) has the molecular formula C16H18ClN3O3S and a molecular weight of 367.86 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
PubChem CID109002569
Molecular FormulaC16H18ClN3O3S
Molecular Weight367.86 g/mol
Exact Mass367.08
IUPAC NameN-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
SMILESNS(=O)(=O)c1ccc(CCNCC(=O)Nc2ccccc2Cl)cc1
InChIInChI=1S/C16H18ClN3O3S/c17-14-3-1-2-4-15(14)20-16(21)11-19-10-9-12-5-7-13(8-6-12)24(18,22)23/h1-8,19H,9-11H2,(H,20,21)(H2,18,22,23)
InChIKeyPMKGNZKGKKZXJW-UHFFFAOYSA-N
XLogP1.76
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.86
LogP ≤ 51.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-naphthalen-1-yl-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 4852522
N-(3-chloro-4-methylphenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 109002575
N-[2-(4-chlorophenyl)ethyl]-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 109002532
N-(2-chloro-4,6-dimethylphenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 109002577
2-[(2-chlorophenyl)methylamino]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 108997936
N-(4-tert-butylphenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 109002567
N-(3-acetylphenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 109002591
N-butan-2-yl-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 108993382
1-(2,6-dichlorophenyl)-3-[2-(4-sulfamoylphenyl)ethyl]urea
CID 108989685
N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide
CID 28579213
N-(2-chlorophenyl)-3-[2-(4-fluorophenyl)ethylamino]propanamide
CID 109025148
2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-N-(4-sulfamoylphenyl)acetamide
CID 2526439

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide (CID 109002569) is N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide is NS(=O)(=O)c1ccc(CCNCC(=O)Nc2ccccc2Cl)cc1.
What is the InChIKey of N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide?
The InChIKey is PMKGNZKGKKZXJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClN3O3S/c17-14-3-1-2-4-15(14)20-16(21)11-19-10-9-12-5-7-13(8-6-12)24(18,22)23/h1-8,19H,9-11H2,(H,20,21)(H2,18,22,23).
What are the key properties of N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide?
N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide has a molecular weight of 367.86 g/mol, XLogP of 1.76, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide is sourced from PubChem (CID 109002569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).