N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide

C10H12N2O4S — CID 14982687

IUPACN-[(4-methylphenyl)sulfonylcarbamoyl]acetamide
SMILESCC(=O)NC(=O)NS(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C10H12N2O4S/c1-7-3-5-9(6-4-7)17(15,16)12-10(14)11-8(2)13/h3-6H,1-2H3,(H2,11,12,13,14)
InChIKeyNWIFRSJMWOEKNP-UHFFFAOYSA-N
MW256.28 g/mol
LogP0.53
Rot. Bonds2

About N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide

N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide (PubChem CID 14982687) has the molecular formula C10H12N2O4S and a molecular weight of 256.28 g/mol. Its IUPAC name is N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide.

Molecular Properties

Compound NameN-[(4-methylphenyl)sulfonylcarbamoyl]acetamide
PubChem CID14982687
Molecular FormulaC10H12N2O4S
Molecular Weight256.28 g/mol
Exact Mass256.05
IUPAC NameN-[(4-methylphenyl)sulfonylcarbamoyl]acetamide
SMILESCC(=O)NC(=O)NS(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C10H12N2O4S/c1-7-3-5-9(6-4-7)17(15,16)12-10(14)11-8(2)13/h3-6H,1-2H3,(H2,11,12,13,14)
InChIKeyNWIFRSJMWOEKNP-UHFFFAOYSA-N
XLogP0.53
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.28
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide?
The IUPAC name of N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide (CID 14982687) is N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide.
What is the SMILES notation for N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide?
The canonical SMILES for N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide is CC(=O)NC(=O)NS(=O)(=O)c1ccc(C)cc1.
What is the InChIKey of N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide?
The InChIKey is NWIFRSJMWOEKNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O4S/c1-7-3-5-9(6-4-7)17(15,16)12-10(14)11-8(2)13/h3-6H,1-2H3,(H2,11,12,13,14).
What are the key properties of N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide?
N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide has a molecular weight of 256.28 g/mol, XLogP of 0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylphenyl)sulfonylcarbamoyl]acetamide is sourced from PubChem (CID 14982687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).