N-(2,6-diethyl-4-sulfamoylphenyl)acetamide

C12H18N2O3S — CID 2726107

IUPACN-(2,6-diethyl-4-sulfamoylphenyl)acetamide
SMILESCCc1cc(S(N)(=O)=O)cc(CC)c1NC(C)=O
InChIInChI=1S/C12H18N2O3S/c1-4-9-6-11(18(13,16)17)7-10(5-2)12(9)14-8(3)15/h6-7H,4-5H2,1-3H3,(H,14,15)(H2,13,16,17)
InChIKeyAVAFJAAZXLHGAZ-UHFFFAOYSA-N
MW270.35 g/mol
LogP1.42
Rot. Bonds4

About N-(2,6-diethyl-4-sulfamoylphenyl)acetamide

N-(2,6-diethyl-4-sulfamoylphenyl)acetamide (PubChem CID 2726107) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is N-(2,6-diethyl-4-sulfamoylphenyl)acetamide.

Molecular Properties

Compound NameN-(2,6-diethyl-4-sulfamoylphenyl)acetamide
PubChem CID2726107
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC NameN-(2,6-diethyl-4-sulfamoylphenyl)acetamide
SMILESCCc1cc(S(N)(=O)=O)cc(CC)c1NC(C)=O
InChIInChI=1S/C12H18N2O3S/c1-4-9-6-11(18(13,16)17)7-10(5-2)12(9)14-8(3)15/h6-7H,4-5H2,1-3H3,(H,14,15)(H2,13,16,17)
InChIKeyAVAFJAAZXLHGAZ-UHFFFAOYSA-N
XLogP1.42
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethyl-4-sulfamoylphenyl)acetamide?
The IUPAC name of N-(2,6-diethyl-4-sulfamoylphenyl)acetamide (CID 2726107) is N-(2,6-diethyl-4-sulfamoylphenyl)acetamide.
What is the SMILES notation for N-(2,6-diethyl-4-sulfamoylphenyl)acetamide?
The canonical SMILES for N-(2,6-diethyl-4-sulfamoylphenyl)acetamide is CCc1cc(S(N)(=O)=O)cc(CC)c1NC(C)=O.
What is the InChIKey of N-(2,6-diethyl-4-sulfamoylphenyl)acetamide?
The InChIKey is AVAFJAAZXLHGAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-4-9-6-11(18(13,16)17)7-10(5-2)12(9)14-8(3)15/h6-7H,4-5H2,1-3H3,(H,14,15)(H2,13,16,17).
What are the key properties of N-(2,6-diethyl-4-sulfamoylphenyl)acetamide?
N-(2,6-diethyl-4-sulfamoylphenyl)acetamide has a molecular weight of 270.35 g/mol, XLogP of 1.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethyl-4-sulfamoylphenyl)acetamide is sourced from PubChem (CID 2726107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).