2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide

C15H13N3O3S — CID 39342828

IUPAC2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide
SMILESN#Cc1ccc(S(=O)(=O)Nc2ccc(CC(N)=O)cc2)cc1
InChIInChI=1S/C15H13N3O3S/c16-10-12-3-7-14(8-4-12)22(20,21)18-13-5-1-11(2-6-13)9-15(17)19/h1-8,18H,9H2,(H2,17,19)
InChIKeyOVFOGMYDEVBWPZ-UHFFFAOYSA-N
MW315.35 g/mol
LogP1.39
Rot. Bonds5

About 2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide

2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide (PubChem CID 39342828) has the molecular formula C15H13N3O3S and a molecular weight of 315.35 g/mol. Its IUPAC name is 2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide.

Molecular Properties

Compound Name2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide
PubChem CID39342828
Molecular FormulaC15H13N3O3S
Molecular Weight315.35 g/mol
Exact Mass315.07
IUPAC Name2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide
SMILESN#Cc1ccc(S(=O)(=O)Nc2ccc(CC(N)=O)cc2)cc1
InChIInChI=1S/C15H13N3O3S/c16-10-12-3-7-14(8-4-12)22(20,21)18-13-5-1-11(2-6-13)9-15(17)19/h1-8,18H,9H2,(H2,17,19)
InChIKeyOVFOGMYDEVBWPZ-UHFFFAOYSA-N
XLogP1.39
TPSA113.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.35
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]-N-propan-2-ylacetamide
CID 38943951
4-cyano-N-[4-(hydroxymethyl)phenyl]benzenesulfonamide
CID 64794703
2-[(4-cyanophenyl)sulfonylamino]acetamide
CID 4844985
(4-cyanophenyl)methyl 4-[(4-methoxyphenyl)sulfamoyl]benzoate
CID 2368222
N-(3-amino-4-ethylphenyl)-4-cyanobenzenesulfonamide
CID 43551091
N-[(4-cyanophenyl)methyl]-4-(phenylsulfamoyl)benzamide
CID 134035426
2-[4-[(4-iodophenyl)sulfamoyl]phenyl]ethanethioamide
CID 79185293
2-[4-(methylsulfamoyl)phenyl]acetamide
CID 118211828
N-(4-cyanophenyl)-2-(4-methylsulfonylphenyl)acetamide
CID 110771370
2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]ethanethioamide
CID 62306143
4-cyano-N-[4-(cyclopropylsulfamoyl)phenyl]benzenesulfonamide
CID 24602920
1-(4-cyanophenyl)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]urea
CID 166182205

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide?
The IUPAC name of 2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide (CID 39342828) is 2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide.
What is the SMILES notation for 2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide?
The canonical SMILES for 2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide is N#Cc1ccc(S(=O)(=O)Nc2ccc(CC(N)=O)cc2)cc1.
What is the InChIKey of 2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide?
The InChIKey is OVFOGMYDEVBWPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3S/c16-10-12-3-7-14(8-4-12)22(20,21)18-13-5-1-11(2-6-13)9-15(17)19/h1-8,18H,9H2,(H2,17,19).
What are the key properties of 2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide?
2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide has a molecular weight of 315.35 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-cyanophenyl)sulfonylamino]phenyl]acetamide is sourced from PubChem (CID 39342828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).