N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide

C11H16BrN3O2S — CID 79730057

IUPACN-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide
SMILESCc1cc(NS(=O)(=O)C2CCCNC2)ncc1Br
InChIInChI=1S/C11H16BrN3O2S/c1-8-5-11(14-7-10(8)12)15-18(16,17)9-3-2-4-13-6-9/h5,7,9,13H,2-4,6H2,1H3,(H,14,15)
InChIKeySGVBEZKUEBRMAB-UHFFFAOYSA-N
MW334.24 g/mol
LogP1.65
Rot. Bonds3

About N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide

N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide (PubChem CID 79730057) has the molecular formula C11H16BrN3O2S and a molecular weight of 334.24 g/mol. Its IUPAC name is N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide.

Molecular Properties

Compound NameN-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide
PubChem CID79730057
Molecular FormulaC11H16BrN3O2S
Molecular Weight334.24 g/mol
Exact Mass333.01
IUPAC NameN-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide
SMILESCc1cc(NS(=O)(=O)C2CCCNC2)ncc1Br
InChIInChI=1S/C11H16BrN3O2S/c1-8-5-11(14-7-10(8)12)15-18(16,17)9-3-2-4-13-6-9/h5,7,9,13H,2-4,6H2,1H3,(H,14,15)
InChIKeySGVBEZKUEBRMAB-UHFFFAOYSA-N
XLogP1.65
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.24
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-bromo-4-methyl-2-pyridinyl)oxane-4-sulfonamide
CID 79729960
N-(5-fluoro-2-pyridinyl)piperidine-3-sulfonamide
CID 65481470
N-(2-bromo-5-chlorophenyl)piperidine-3-sulfonamide
CID 81280209
N-(2,5-dimethylphenyl)piperidine-3-sulfonamide
CID 24699757
N-(2-bromophenyl)piperidine-3-sulfonamide
CID 54974199
N-(2,4-dibromo-5-methoxyphenyl)piperidine-3-sulfonamide
CID 103415161
N-(2-bromo-4-fluorophenyl)piperidine-3-sulfonamide
CID 54972062
N-(5-bromo-4-methyl-2-pyridinyl)-2-pyrrolidin-3-ylacetamide
CID 79733319
N-(3-bromo-2,4-difluorophenyl)piperidine-3-sulfonamide
CID 155193788
N-(2-methoxy-4-pyridinyl)piperidine-3-sulfonamide
CID 112739564
N-(2-fluoro-4-methylphenyl)piperidine-3-sulfonamide
CID 43114273
N-(5-bromo-4-methyl-2-pyridinyl)-2,5-dichlorobenzenesulfonamide
CID 79729132

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide?
The IUPAC name of N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide (CID 79730057) is N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide.
What is the SMILES notation for N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide?
The canonical SMILES for N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide is Cc1cc(NS(=O)(=O)C2CCCNC2)ncc1Br.
What is the InChIKey of N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide?
The InChIKey is SGVBEZKUEBRMAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3O2S/c1-8-5-11(14-7-10(8)12)15-18(16,17)9-3-2-4-13-6-9/h5,7,9,13H,2-4,6H2,1H3,(H,14,15).
What are the key properties of N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide?
N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide has a molecular weight of 334.24 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-4-methyl-2-pyridinyl)piperidine-3-sulfonamide is sourced from PubChem (CID 79730057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).