(5-bromo-2-fluorophenyl)methanesulfonamide

C7H7BrFNO2S — CID 61064236

IUPAC(5-bromo-2-fluorophenyl)methanesulfonamide
SMILESNS(=O)(=O)Cc1cc(Br)ccc1F
InChIInChI=1S/C7H7BrFNO2S/c8-6-1-2-7(9)5(3-6)4-13(10,11)12/h1-3H,4H2,(H2,10,11,12)
InChIKeyOEWOJLPLQZXOEL-UHFFFAOYSA-N
MW268.11 g/mol
LogP1.38
Rot. Bonds2

About (5-bromo-2-fluorophenyl)methanesulfonamide

(5-bromo-2-fluorophenyl)methanesulfonamide (PubChem CID 61064236) has the molecular formula C7H7BrFNO2S and a molecular weight of 268.11 g/mol. Its IUPAC name is (5-bromo-2-fluorophenyl)methanesulfonamide.

Molecular Properties

Compound Name(5-bromo-2-fluorophenyl)methanesulfonamide
PubChem CID61064236
Molecular FormulaC7H7BrFNO2S
Molecular Weight268.11 g/mol
Exact Mass266.94
IUPAC Name(5-bromo-2-fluorophenyl)methanesulfonamide
SMILESNS(=O)(=O)Cc1cc(Br)ccc1F
InChIInChI=1S/C7H7BrFNO2S/c8-6-1-2-7(9)5(3-6)4-13(10,11)12/h1-3H,4H2,(H2,10,11,12)
InChIKeyOEWOJLPLQZXOEL-UHFFFAOYSA-N
XLogP1.38
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.11
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,4-dibromophenyl)methanesulfonamide
CID 107944156
4-bromo-2-ethyl-1-fluorobenzene
CID 22641025
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CID 62622009
1-(5-bromo-2-fluorophenyl)-N-(methylsulfamoyl)methanamine
CID 114808753
2-amino-5-bromo-N-[(5-bromo-2-fluorophenyl)methyl]benzenesulfonamide
CID 61298867
4-amino-3-[(5-bromo-2-fluorophenyl)methylamino]benzenesulfonamide
CID 82900077
3-[(5-bromo-2-fluorophenyl)methylamino]-4-methylbenzenesulfonamide
CID 43744162
1-(5-bromo-2-fluorophenyl)-3-methylsulfonylpropan-2-ol
CID 115601604
2-(5-bromo-2-fluorophenyl)-N'-hydroxyethanimidamide
CID 57364800
N-[(5-bromo-2-fluorophenyl)methyl]-N-(2-hydroxyethyl)ethanesulfonamide
CID 111439949
1-(5-bromo-2-fluorophenyl)-3-methylsulfonylbutan-2-ol
CID 115784947
N-(2-aminoethyl)-2-(5-bromo-2-fluorophenyl)acetamide
CID 82648185

Frequently Asked Questions

What is the IUPAC name of (5-bromo-2-fluorophenyl)methanesulfonamide?
The IUPAC name of (5-bromo-2-fluorophenyl)methanesulfonamide (CID 61064236) is (5-bromo-2-fluorophenyl)methanesulfonamide.
What is the SMILES notation for (5-bromo-2-fluorophenyl)methanesulfonamide?
The canonical SMILES for (5-bromo-2-fluorophenyl)methanesulfonamide is NS(=O)(=O)Cc1cc(Br)ccc1F.
What is the InChIKey of (5-bromo-2-fluorophenyl)methanesulfonamide?
The InChIKey is OEWOJLPLQZXOEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrFNO2S/c8-6-1-2-7(9)5(3-6)4-13(10,11)12/h1-3H,4H2,(H2,10,11,12).
What are the key properties of (5-bromo-2-fluorophenyl)methanesulfonamide?
(5-bromo-2-fluorophenyl)methanesulfonamide has a molecular weight of 268.11 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-2-fluorophenyl)methanesulfonamide is sourced from PubChem (CID 61064236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).