5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide

C12H19BrN4O2S — CID 61298927

IUPAC5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
SMILESCC1CCCC(NS(=O)(=O)c2cc(Br)cnc2NN)C1
InChIInChI=1S/C12H19BrN4O2S/c1-8-3-2-4-10(5-8)17-20(18,19)11-6-9(13)7-15-12(11)16-14/h6-8,10,17H,2-5,14H2,1H3,(H,15,16)
InChIKeyJFPMLQAVZNRMFZ-UHFFFAOYSA-N
MW363.28 g/mol
LogP1.99
Rot. Bonds4

About 5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide

5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide (PubChem CID 61298927) has the molecular formula C12H19BrN4O2S and a molecular weight of 363.28 g/mol. Its IUPAC name is 5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
PubChem CID61298927
Molecular FormulaC12H19BrN4O2S
Molecular Weight363.28 g/mol
Exact Mass362.04
IUPAC Name5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
SMILESCC1CCCC(NS(=O)(=O)c2cc(Br)cnc2NN)C1
InChIInChI=1S/C12H19BrN4O2S/c1-8-3-2-4-10(5-8)17-20(18,19)11-6-9(13)7-15-12(11)16-14/h6-8,10,17H,2-5,14H2,1H3,(H,15,16)
InChIKeyJFPMLQAVZNRMFZ-UHFFFAOYSA-N
XLogP1.99
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.28
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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-(1-methylpiperidin-4-yl)pyridine-3-sulfonamide
CID 61299121
5-bromo-2-hydrazinyl-N-(3-methoxycyclobutyl)pyridine-3-sulfonamide
CID 114119962
2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 43456995
5-bromo-N-(3,3-dimethylcyclopentyl)-2-hydrazinylpyridine-3-sulfonamide
CID 114548138
5-bromo-N-(1,1-dioxothiolan-3-yl)-2-hydrazinylpyridine-3-sulfonamide
CID 61301424
5-bromo-N-(3-ethyl-2-methylcyclopentyl)-2-hydrazinylpyridine-3-sulfonamide
CID 64916624
5-bromo-N-cyclopentyl-2-(ethylamino)pyridine-3-sulfonamide
CID 62148815
5-bromo-2-chloro-N-(3-methylcyclobutyl)pyridine-3-sulfonamide
CID 115672191
5-amino-N-(3-methylcyclohexyl)-1H-pyrazole-4-sulfonamide
CID 60809111
5-bromo-2-hydrazinyl-N',N'-dimethylpyridine-3-sulfonohydrazide
CID 83025691
5-bromo-N-(2,2-dimethylpropyl)-2-hydrazinylpyridine-3-sulfonamide
CID 61298746

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
The IUPAC name of 5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide (CID 61298927) is 5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
The canonical SMILES for 5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide is CC1CCCC(NS(=O)(=O)c2cc(Br)cnc2NN)C1.
What is the InChIKey of 5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
The InChIKey is JFPMLQAVZNRMFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19BrN4O2S/c1-8-3-2-4-10(5-8)17-20(18,19)11-6-9(13)7-15-12(11)16-14/h6-8,10,17H,2-5,14H2,1H3,(H,15,16).
What are the key properties of 5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide has a molecular weight of 363.28 g/mol, XLogP of 1.99, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide is sourced from PubChem (CID 61298927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).