N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide

C16H16ClN3O4S — CID 112999785

IUPACN-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CNS(=O)(=O)c2cccc(Cl)c2)cc1
InChIInChI=1S/C16H16ClN3O4S/c1-11(21)19-13-5-7-14(8-6-13)20-16(22)10-18-25(23,24)15-4-2-3-12(17)9-15/h2-9,18H,10H2,1H3,(H,19,21)(H,20,22)
InChIKeyBPUKFKFYHOUORN-UHFFFAOYSA-N
MW381.84 g/mol
LogP2.22
Rot. Bonds6

About N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide

N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide (PubChem CID 112999785) has the molecular formula C16H16ClN3O4S and a molecular weight of 381.84 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide
PubChem CID112999785
Molecular FormulaC16H16ClN3O4S
Molecular Weight381.84 g/mol
Exact Mass381.06
IUPAC NameN-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CNS(=O)(=O)c2cccc(Cl)c2)cc1
InChIInChI=1S/C16H16ClN3O4S/c1-11(21)19-13-5-7-14(8-6-13)20-16(22)10-18-25(23,24)15-4-2-3-12(17)9-15/h2-9,18H,10H2,1H3,(H,19,21)(H,20,22)
InChIKeyBPUKFKFYHOUORN-UHFFFAOYSA-N
XLogP2.22
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.84
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 4-[[2-[(3-chlorophenyl)sulfonylamino]acetyl]amino]benzoate
CID 113000819
N-(4-acetamidophenyl)-2-[(4-chloro-3-methylphenyl)sulfonylamino]acetamide
CID 112999779
N-(4-chloro-2-methylphenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide
CID 112998154
N-(4-acetamidophenyl)-3-(3-chlorophenyl)sulfonylpropanamide
CID 110423914
2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide
CID 112998145
N-(4-acetamidophenyl)-2-[(4-bromophenyl)sulfonylamino]acetamide
CID 1316272
2-[(4-acetamidophenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998688
N-(3-chlorophenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]acetamide
CID 9042351
N-(4-acetylphenyl)-2-[(4-chlorophenyl)sulfonylamino]acetamide
CID 112999628
N-(4-acetamidophenyl)-2-[(4-methoxy-3-methylphenyl)sulfonylamino]acetamide
CID 112999771
4-[3-[(3-chlorophenyl)sulfonylamino]propanoylamino]benzamide
CID 26636174
N-(3,4-dimethylphenyl)-2-[(3-methylphenyl)sulfonylamino]acetamide
CID 112996585

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide (CID 112999785) is N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide is CC(=O)Nc1ccc(NC(=O)CNS(=O)(=O)c2cccc(Cl)c2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide?
The InChIKey is BPUKFKFYHOUORN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3O4S/c1-11(21)19-13-5-7-14(8-6-13)20-16(22)10-18-25(23,24)15-4-2-3-12(17)9-15/h2-9,18H,10H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide?
N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide has a molecular weight of 381.84 g/mol, XLogP of 2.22, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide is sourced from PubChem (CID 112999785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).