5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide

C11H18BrN5O2S — CID 61299121

IUPAC5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide
SMILESCN1CCC(NS(=O)(=O)c2cc(Br)cnc2NN)CC1
InChIInChI=1S/C11H18BrN5O2S/c1-17-4-2-9(3-5-17)16-20(18,19)10-6-8(12)7-14-11(10)15-13/h6-7,9,16H,2-5,13H2,1H3,(H,14,15)
InChIKeyHSIVTOYFSDLVKX-UHFFFAOYSA-N
MW364.27 g/mol
LogP0.50
Rot. Bonds4

About 5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide

5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide (PubChem CID 61299121) has the molecular formula C11H18BrN5O2S and a molecular weight of 364.27 g/mol. Its IUPAC name is 5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide
PubChem CID61299121
Molecular FormulaC11H18BrN5O2S
Molecular Weight364.27 g/mol
Exact Mass363.04
IUPAC Name5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide
SMILESCN1CCC(NS(=O)(=O)c2cc(Br)cnc2NN)CC1
InChIInChI=1S/C11H18BrN5O2S/c1-17-4-2-9(3-5-17)16-20(18,19)10-6-8(12)7-14-11(10)15-13/h6-7,9,16H,2-5,13H2,1H3,(H,14,15)
InChIKeyHSIVTOYFSDLVKX-UHFFFAOYSA-N
XLogP0.50
TPSA100.35 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.27
LogP ≤ 50.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-bromo-N-cyclobutyl-2-hydrazinylpyridine-3-sulfonamide
CID 62414810
5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 61298927
5-bromo-N-(1,1-dioxothiolan-3-yl)-2-hydrazinylpyridine-3-sulfonamide
CID 61301424
5-bromo-N-(3,3-dimethylcyclopentyl)-2-hydrazinylpyridine-3-sulfonamide
CID 114548138
5-bromo-2-hydrazinyl-N-(3-methoxycyclobutyl)pyridine-3-sulfonamide
CID 114119962
5-bromo-N-cyclopentyl-2-(ethylamino)pyridine-3-sulfonamide
CID 62148815
5-bromo-N-(3-ethyl-2-methylcyclopentyl)-2-hydrazinylpyridine-3-sulfonamide
CID 64916624
5-bromo-2-hydrazinyl-N-piperidin-1-ylpyridine-3-sulfonamide
CID 83025411
5-bromo-2-hydrazinyl-N',N'-dimethylpyridine-3-sulfonohydrazide
CID 83025691
5-bromo-N-(2,2-dimethylpropyl)-2-hydrazinylpyridine-3-sulfonamide
CID 61298746
1-[(5-bromo-2-hydrazinyl-3-pyridinyl)sulfonyl]-N,N-dimethylpiperidin-4-amine
CID 61298550
[5-bromo-3-(4-methoxypiperidin-1-yl)sulfonyl-2-pyridinyl]hydrazine
CID 61299120

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide?
The IUPAC name of 5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide (CID 61299121) is 5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide?
The canonical SMILES for 5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide is CN1CCC(NS(=O)(=O)c2cc(Br)cnc2NN)CC1.
What is the InChIKey of 5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide?
The InChIKey is HSIVTOYFSDLVKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18BrN5O2S/c1-17-4-2-9(3-5-17)16-20(18,19)10-6-8(12)7-14-11(10)15-13/h6-7,9,16H,2-5,13H2,1H3,(H,14,15).
What are the key properties of 5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide?
5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide has a molecular weight of 364.27 g/mol, XLogP of 0.50, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-hydrazinyl-N-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 61299121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).