N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide

C10H13BrN2O4S — CID 43134112

IUPACN-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide
SMILESCCOCC(=O)Nc1ccc(S(N)(=O)=O)cc1Br
InChIInChI=1S/C10H13BrN2O4S/c1-2-17-6-10(14)13-9-4-3-7(5-8(9)11)18(12,15)16/h3-5H,2,6H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyOPWASDNVPFNGEL-UHFFFAOYSA-N
MW337.20 g/mol
LogP1.07
Rot. Bonds5

About N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide

N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide (PubChem CID 43134112) has the molecular formula C10H13BrN2O4S and a molecular weight of 337.20 g/mol. Its IUPAC name is N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide.

Molecular Properties

Compound NameN-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide
PubChem CID43134112
Molecular FormulaC10H13BrN2O4S
Molecular Weight337.20 g/mol
Exact Mass335.98
IUPAC NameN-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide
SMILESCCOCC(=O)Nc1ccc(S(N)(=O)=O)cc1Br
InChIInChI=1S/C10H13BrN2O4S/c1-2-17-6-10(14)13-9-4-3-7(5-8(9)11)18(12,15)16/h3-5H,2,6H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyOPWASDNVPFNGEL-UHFFFAOYSA-N
XLogP1.07
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.20
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chloro-5-sulfamoylphenyl)-2-ethoxyacetamide
CID 61130321
N-[2-bromo-4-[(Z)-N'-hydroxycarbamimidoyl]phenyl]-2-ethoxyacetamide
CID 114001897
2-amino-N-[2-(2-bromo-4-sulfamoylanilino)-2-oxoethyl]acetamide
CID 10666501
N-(5-amino-2-bromo-4-methylphenyl)-2-ethoxyacetamide
CID 104814501
2-amino-N-(2-bromo-4-sulfamoylphenyl)-2-methylbutanamide
CID 79797019
3-ethoxy-N-(2-fluoro-4-sulfamoylphenyl)propanamide
CID 55091208
N-(2-methyl-4-sulfamoylphenyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 103208716
2-amino-N-(2-bromo-4-sulfamoylphenyl)-2-methylpropanamide
CID 61265216
N-(2-methyl-4-sulfamoylphenyl)propanamide
CID 43133967
2-(2-aminoethoxy)-N-(2-methoxy-5-sulfamoylphenyl)acetamide
CID 79473829
N-(2-amino-4-chlorophenyl)-2-ethoxyacetamide
CID 16791800
4-bromo-N-(2-bromo-4-sulfamoylphenyl)benzamide
CID 43246759

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide?
The IUPAC name of N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide (CID 43134112) is N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide.
What is the SMILES notation for N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide?
The canonical SMILES for N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide is CCOCC(=O)Nc1ccc(S(N)(=O)=O)cc1Br.
What is the InChIKey of N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide?
The InChIKey is OPWASDNVPFNGEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2O4S/c1-2-17-6-10(14)13-9-4-3-7(5-8(9)11)18(12,15)16/h3-5H,2,6H2,1H3,(H,13,14)(H2,12,15,16).
What are the key properties of N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide?
N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide has a molecular weight of 337.20 g/mol, XLogP of 1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-sulfamoylphenyl)-2-ethoxyacetamide is sourced from PubChem (CID 43134112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).