N-(5-bromo-2-pyridinyl)methanesulfonamide

C6H7BrN2O2S — CID 790872

IUPACN-(5-bromo-2-pyridinyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(Br)cn1
InChIInChI=1S/C6H7BrN2O2S/c1-12(10,11)9-6-3-2-5(7)4-8-6/h2-4H,1H3,(H,8,9)
InChIKeyWOYAADKYEDTQCR-UHFFFAOYSA-N
MW251.11 g/mol
LogP1.22
Rot. Bonds2

About N-(5-bromo-2-pyridinyl)methanesulfonamide

N-(5-bromo-2-pyridinyl)methanesulfonamide (PubChem CID 790872) has the molecular formula C6H7BrN2O2S and a molecular weight of 251.11 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)methanesulfonamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)methanesulfonamide
PubChem CID790872
Molecular FormulaC6H7BrN2O2S
Molecular Weight251.11 g/mol
Exact Mass249.94
IUPAC NameN-(5-bromo-2-pyridinyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(Br)cn1
InChIInChI=1S/C6H7BrN2O2S/c1-12(10,11)9-6-3-2-5(7)4-8-6/h2-4H,1H3,(H,8,9)
InChIKeyWOYAADKYEDTQCR-UHFFFAOYSA-N
XLogP1.22
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.11
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-N-(5-bromo-2-pyridinyl)benzenesulfonamide
CID 3811085
N-(5-bromo-2-pyridinyl)-4-methylbenzenesulfonamide
CID 673877
N-(5-methoxy-2-pyridinyl)methanesulfonamide
CID 67233634
5-bromo-N-(2-methylpropylsulfamoyl)pyridin-2-amine
CID 114815452
N-[5-(2-bromoanilino)-2-pyridinyl]methanesulfonamide
CID 113035997
N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide
CID 3320967
N-(5-bromo-2-pyridinyl)cyclohexanesulfonamide
CID 63905369
4-(1-aminoethyl)-N-(5-bromo-2-pyridinyl)benzenesulfonamide
CID 43114385
N-(5-bromo-2-pyridinyl)thiophene-2-sulfonamide
CID 778331
N-(5-bromo-2-pyridinyl)-1H-pyrrole-2-sulfonamide
CID 115273979
N-(5-bromo-2-pyridinyl)-4-(ethylaminomethyl)-5-methyl-1H-pyrazole-3-sulfonamide
CID 106020549
N-(5-bromo-2-pyridinyl)-4-fluoro-2-methylbenzenesulfonamide
CID 60723562

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)methanesulfonamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)methanesulfonamide (CID 790872) is N-(5-bromo-2-pyridinyl)methanesulfonamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)methanesulfonamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)methanesulfonamide is CS(=O)(=O)Nc1ccc(Br)cn1.
What is the InChIKey of N-(5-bromo-2-pyridinyl)methanesulfonamide?
The InChIKey is WOYAADKYEDTQCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7BrN2O2S/c1-12(10,11)9-6-3-2-5(7)4-8-6/h2-4H,1H3,(H,8,9).
What are the key properties of N-(5-bromo-2-pyridinyl)methanesulfonamide?
N-(5-bromo-2-pyridinyl)methanesulfonamide has a molecular weight of 251.11 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)methanesulfonamide is sourced from PubChem (CID 790872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).