N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide

C15H16ClN3O4S — CID 100828541

IUPACN-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide
SMILESCOc1cc(N)cc(Cl)c1NS(=O)(=O)c1ccc(NC(C)=O)cc1
InChIInChI=1S/C15H16ClN3O4S/c1-9(20)18-11-3-5-12(6-4-11)24(21,22)19-15-13(16)7-10(17)8-14(15)23-2/h3-8,19H,17H2,1-2H3,(H,18,20)
InChIKeyYSALKPRJFJOVBJ-UHFFFAOYSA-N
MW369.83 g/mol
LogP2.69
Rot. Bonds5

About N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide

N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide (PubChem CID 100828541) has the molecular formula C15H16ClN3O4S and a molecular weight of 369.83 g/mol. Its IUPAC name is N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide
PubChem CID100828541
Molecular FormulaC15H16ClN3O4S
Molecular Weight369.83 g/mol
Exact Mass369.06
IUPAC NameN-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide
SMILESCOc1cc(N)cc(Cl)c1NS(=O)(=O)c1ccc(NC(C)=O)cc1
InChIInChI=1S/C15H16ClN3O4S/c1-9(20)18-11-3-5-12(6-4-11)24(21,22)19-15-13(16)7-10(17)8-14(15)23-2/h3-8,19H,17H2,1-2H3,(H,18,20)
InChIKeyYSALKPRJFJOVBJ-UHFFFAOYSA-N
XLogP2.69
TPSA110.52 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.83
LogP ≤ 52.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[4-[(4-amino-3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide
CID 8538672
N-[4-[(2-methoxy-4,5-dimethylphenyl)sulfamoyl]phenyl]acetamide
CID 110776847
N-[4-[(3,4-dichlorophenyl)sulfonylamino]-2-methoxyphenyl]acetamide
CID 55902732
N-(3-chloro-4-methoxyphenyl)-4-hydrazinylbenzenesulfonamide
CID 43454822
N-[4-[(5-amino-2-pyridinyl)sulfamoyl]phenyl]acetamide
CID 43328729
N-[4-[(2,3,4,5,6-pentafluorophenyl)sulfamoyl]phenyl]acetamide
CID 5193248
N-[4-[[2-(2,4-dichlorophenoxy)-6-fluorophenyl]sulfamoyl]phenyl]acetamide
CID 11155608
(2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2,5-dimethoxyphenyl)propanamide
CID 55942705
methyl 4-[(4-acetamidophenyl)sulfonylamino]benzoate
CID 669173
N-(4-amino-2-chloro-6-methoxyphenyl)-4-iodobenzamide
CID 100828565
methyl 4-[(3-chloro-4-methoxyphenyl)sulfamoyl]benzoate
CID 26487204
N-[4-[(3-chloro-4-fluorophenyl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 8501064

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide (CID 100828541) is N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide is COc1cc(N)cc(Cl)c1NS(=O)(=O)c1ccc(NC(C)=O)cc1.
What is the InChIKey of N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide?
The InChIKey is YSALKPRJFJOVBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O4S/c1-9(20)18-11-3-5-12(6-4-11)24(21,22)19-15-13(16)7-10(17)8-14(15)23-2/h3-8,19H,17H2,1-2H3,(H,18,20).
What are the key properties of N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide?
N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide has a molecular weight of 369.83 g/mol, XLogP of 2.69, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-amino-2-chloro-6-methoxyphenyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 100828541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).