5-bromo-2-ethoxybenzenesulfonamide

C8H10BrNO3S — CID 2321418

IUPAC5-bromo-2-ethoxybenzenesulfonamide
SMILESCCOc1ccc(Br)cc1S(N)(=O)=O
InChIInChI=1S/C8H10BrNO3S/c1-2-13-7-4-3-6(9)5-8(7)14(10,11)12/h3-5H,2H2,1H3,(H2,10,11,12)
InChIKeyDWEBAXUXUGSGPJ-UHFFFAOYSA-N
MW280.14 g/mol
LogP1.50
Rot. Bonds3

About 5-bromo-2-ethoxybenzenesulfonamide

5-bromo-2-ethoxybenzenesulfonamide (PubChem CID 2321418) has the molecular formula C8H10BrNO3S and a molecular weight of 280.14 g/mol. Its IUPAC name is 5-bromo-2-ethoxybenzenesulfonamide.

Molecular Properties

Compound Name5-bromo-2-ethoxybenzenesulfonamide
PubChem CID2321418
Molecular FormulaC8H10BrNO3S
Molecular Weight280.14 g/mol
Exact Mass278.96
IUPAC Name5-bromo-2-ethoxybenzenesulfonamide
SMILESCCOc1ccc(Br)cc1S(N)(=O)=O
InChIInChI=1S/C8H10BrNO3S/c1-2-13-7-4-3-6(9)5-8(7)14(10,11)12/h3-5H,2H2,1H3,(H2,10,11,12)
InChIKeyDWEBAXUXUGSGPJ-UHFFFAOYSA-N
XLogP1.50
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.14
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-((5-Bromo-2-ethoxyphenyl)sulfonyl)thiazolidine
CID 1236384
5-bromo-N,N-diethyl-2-methoxybenzenesulfonamide
CID 882981
5-Bromo-2-methoxybenzene-1-sulfonyl chloride
CID 520020
1-(5-Bromo-2-methoxyphenylsulfonyl)pyrrolidine
CID 700232
4-Bromo-2-(1-pyrrolidinylsulfonyl)phenyl ethyl ether
CID 700235
4-[(5-Bromo-2-ethoxyphenyl)sulfonyl]-2,6-dimethylmorpholine
CID 2933068
5-bromo-N-ethyl-2-methoxybenzenesulfonamide
CID 935464
5-Bromo-2-ethoxybenzene-1-sulfonyl chloride
CID 3688333
4-(2-Bromoethoxy)benzene-1-sulfonamide
CID 4962801
5-bromo-2-methoxy-N-(2-methoxyethyl)benzenesulfonamide
CID 1587715
1-(5-Bromo-2-ethoxyphenyl)sulfonyl-4-methyl-1,4-diazepane
CID 2561928
5-bromo-N-cyclopentyl-2-ethoxybenzenesulfonamide
CID 4789633

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-ethoxybenzenesulfonamide?
The IUPAC name of 5-bromo-2-ethoxybenzenesulfonamide (CID 2321418) is 5-bromo-2-ethoxybenzenesulfonamide.
What is the SMILES notation for 5-bromo-2-ethoxybenzenesulfonamide?
The canonical SMILES for 5-bromo-2-ethoxybenzenesulfonamide is CCOc1ccc(Br)cc1S(N)(=O)=O.
What is the InChIKey of 5-bromo-2-ethoxybenzenesulfonamide?
The InChIKey is DWEBAXUXUGSGPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrNO3S/c1-2-13-7-4-3-6(9)5-8(7)14(10,11)12/h3-5H,2H2,1H3,(H2,10,11,12).
What are the key properties of 5-bromo-2-ethoxybenzenesulfonamide?
5-bromo-2-ethoxybenzenesulfonamide has a molecular weight of 280.14 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-ethoxybenzenesulfonamide is sourced from PubChem (CID 2321418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).