N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide

C20H19N3O3S — CID 2869290

IUPACN-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(Nc3ccccc3)cc2)cc1
InChIInChI=1S/C20H19N3O3S/c1-15(24)21-17-11-13-20(14-12-17)27(25,26)23-19-9-7-18(8-10-19)22-16-5-3-2-4-6-16/h2-14,22-23H,1H3,(H,21,24)
InChIKeyJEKUPALYKLLNGT-UHFFFAOYSA-N
MW381.46 g/mol
LogP4.19
Rot. Bonds6

About N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide

N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide (PubChem CID 2869290) has the molecular formula C20H19N3O3S and a molecular weight of 381.46 g/mol. Its IUPAC name is N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide
PubChem CID2869290
Molecular FormulaC20H19N3O3S
Molecular Weight381.46 g/mol
Exact Mass381.11
IUPAC NameN-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(Nc3ccccc3)cc2)cc1
InChIInChI=1S/C20H19N3O3S/c1-15(24)21-17-11-13-20(14-12-17)27(25,26)23-19-9-7-18(8-10-19)22-16-5-3-2-4-6-16/h2-14,22-23H,1H3,(H,21,24)
InChIKeyJEKUPALYKLLNGT-UHFFFAOYSA-N
XLogP4.19
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 54.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide (CID 2869290) is N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(Nc3ccccc3)cc2)cc1.
What is the InChIKey of N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide?
The InChIKey is JEKUPALYKLLNGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S/c1-15(24)21-17-11-13-20(14-12-17)27(25,26)23-19-9-7-18(8-10-19)22-16-5-3-2-4-6-16/h2-14,22-23H,1H3,(H,21,24).
What are the key properties of N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide?
N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide has a molecular weight of 381.46 g/mol, XLogP of 4.19, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-anilinophenyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 2869290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).