2-(2-bromophenyl)ethanesulfonamide

C8H10BrNO2S — CID 91666727

IUPAC2-(2-bromophenyl)ethanesulfonamide
SMILESNS(=O)(=O)CCc1ccccc1Br
InChIInChI=1S/C8H10BrNO2S/c9-8-4-2-1-3-7(8)5-6-13(10,11)12/h1-4H,5-6H2,(H2,10,11,12)
InChIKeyJAWVVMFAOOKVSV-UHFFFAOYSA-N
MW264.14 g/mol
LogP1.28
Rot. Bonds3

About 2-(2-bromophenyl)ethanesulfonamide

2-(2-bromophenyl)ethanesulfonamide (PubChem CID 91666727) has the molecular formula C8H10BrNO2S and a molecular weight of 264.14 g/mol. Its IUPAC name is 2-(2-bromophenyl)ethanesulfonamide.

Molecular Properties

Compound Name2-(2-bromophenyl)ethanesulfonamide
PubChem CID91666727
Molecular FormulaC8H10BrNO2S
Molecular Weight264.14 g/mol
Exact Mass262.96
IUPAC Name2-(2-bromophenyl)ethanesulfonamide
SMILESNS(=O)(=O)CCc1ccccc1Br
InChIInChI=1S/C8H10BrNO2S/c9-8-4-2-1-3-7(8)5-6-13(10,11)12/h1-4H,5-6H2,(H2,10,11,12)
InChIKeyJAWVVMFAOOKVSV-UHFFFAOYSA-N
XLogP1.28
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.14
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)ethanesulfonamide?
The IUPAC name of 2-(2-bromophenyl)ethanesulfonamide (CID 91666727) is 2-(2-bromophenyl)ethanesulfonamide.
What is the SMILES notation for 2-(2-bromophenyl)ethanesulfonamide?
The canonical SMILES for 2-(2-bromophenyl)ethanesulfonamide is NS(=O)(=O)CCc1ccccc1Br.
What is the InChIKey of 2-(2-bromophenyl)ethanesulfonamide?
The InChIKey is JAWVVMFAOOKVSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrNO2S/c9-8-4-2-1-3-7(8)5-6-13(10,11)12/h1-4H,5-6H2,(H2,10,11,12).
What are the key properties of 2-(2-bromophenyl)ethanesulfonamide?
2-(2-bromophenyl)ethanesulfonamide has a molecular weight of 264.14 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)ethanesulfonamide is sourced from PubChem (CID 91666727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).