2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide

C15H11Cl2N3O3S — CID 17069573

IUPAC2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide
SMILESN#CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)cc(Cl)c2)cc1
InChIInChI=1S/C15H11Cl2N3O3S/c16-10-7-11(17)9-13(8-10)20-24(22,23)14-3-1-12(2-4-14)19-15(21)5-6-18/h1-4,7-9,20H,5H2,(H,19,21)
InChIKeyDUOREMSKTWAATH-UHFFFAOYSA-N
MW384.24 g/mol
LogP3.65
Rot. Bonds5

About 2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide

2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide (PubChem CID 17069573) has the molecular formula C15H11Cl2N3O3S and a molecular weight of 384.24 g/mol. Its IUPAC name is 2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound Name2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide
PubChem CID17069573
Molecular FormulaC15H11Cl2N3O3S
Molecular Weight384.24 g/mol
Exact Mass382.99
IUPAC Name2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide
SMILESN#CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)cc(Cl)c2)cc1
InChIInChI=1S/C15H11Cl2N3O3S/c16-10-7-11(17)9-13(8-10)20-24(22,23)14-3-1-12(2-4-14)19-15(21)5-6-18/h1-4,7-9,20H,5H2,(H,19,21)
InChIKeyDUOREMSKTWAATH-UHFFFAOYSA-N
XLogP3.65
TPSA99.06 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.24
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyano-N-[4-(ethylsulfamoyl)phenyl]acetamide
CID 17070813
N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-3-piperidin-1-ylpropanamide
CID 4571611
N-(3,5-dichlorophenyl)-4-(2,2-dicyanoethenylamino)benzenesulfonamide
CID 168543235
2-cyano-N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl]acetamide
CID 168521474
N-[(E)-1-[4-[(4-chlorophenyl)sulfonylamino]phenyl]ethylideneamino]-2-cyanoacetamide
CID 127048849
2-cyano-N-(4-propan-2-ylsulfonylphenyl)acetamide
CID 115172909
methyl 4-[(3,5-dichlorophenyl)sulfamoyl]benzoate
CID 24509913
2-cyano-N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]acetamide
CID 168520143
N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-3-(3,4-diethoxyphenyl)propanamide
CID 43885129
N-(3,5-dichlorophenyl)-4-(methanesulfonamido)benzenesulfonamide
CID 1290637
N-(3-chlorophenyl)-4-[(2-cyanoacetyl)amino]benzamide
CID 2475447
N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-2-fluorobenzamide
CID 17069483

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of 2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide (CID 17069573) is 2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for 2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for 2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide is N#CCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)cc(Cl)c2)cc1.
What is the InChIKey of 2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide?
The InChIKey is DUOREMSKTWAATH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3O3S/c16-10-7-11(17)9-13(8-10)20-24(22,23)14-3-1-12(2-4-14)19-15(21)5-6-18/h1-4,7-9,20H,5H2,(H,19,21).
What are the key properties of 2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide?
2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide has a molecular weight of 384.24 g/mol, XLogP of 3.65, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 17069573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).