N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide

C11H14N2O4S — CID 163607552

IUPACN-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide
SMILESCCc1ccc(S(=O)(=O)NC(=O)NC(C)=O)cc1
InChIInChI=1S/C11H14N2O4S/c1-3-9-4-6-10(7-5-9)18(16,17)13-11(15)12-8(2)14/h4-7H,3H2,1-2H3,(H2,12,13,14,15)
InChIKeyHDBNMHKCOGOQJY-UHFFFAOYSA-N
MW270.31 g/mol
LogP0.78
Rot. Bonds3

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

N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide (PubChem CID 163607552) has the molecular formula C11H14N2O4S and a molecular weight of 270.31 g/mol. Its IUPAC name is N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide.

Molecular Properties

Compound NameN-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide
PubChem CID163607552
Molecular FormulaC11H14N2O4S
Molecular Weight270.31 g/mol
Exact Mass270.07
IUPAC NameN-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide
SMILESCCc1ccc(S(=O)(=O)NC(=O)NC(C)=O)cc1
InChIInChI=1S/C11H14N2O4S/c1-3-9-4-6-10(7-5-9)18(16,17)13-11(15)12-8(2)14/h4-7H,3H2,1-2H3,(H2,12,13,14,15)
InChIKeyHDBNMHKCOGOQJY-UHFFFAOYSA-N
XLogP0.78
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide?
The IUPAC name of N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide (CID 163607552) is N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide.
What is the SMILES notation for N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide?
The canonical SMILES for N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide is CCc1ccc(S(=O)(=O)NC(=O)NC(C)=O)cc1.
What is the InChIKey of N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide?
The InChIKey is HDBNMHKCOGOQJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O4S/c1-3-9-4-6-10(7-5-9)18(16,17)13-11(15)12-8(2)14/h4-7H,3H2,1-2H3,(H2,12,13,14,15).
What are the key properties of N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide?
N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide has a molecular weight of 270.31 g/mol, XLogP of 0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)sulfonylcarbamoyl]acetamide is sourced from PubChem (CID 163607552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).