[5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine

C11H18BrN5O2S — CID 61301039

IUPAC[5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine
SMILESCCN1CCN(S(=O)(=O)c2cc(Br)cnc2NN)CC1
InChIInChI=1S/C11H18BrN5O2S/c1-2-16-3-5-17(6-4-16)20(18,19)10-7-9(12)8-14-11(10)15-13/h7-8H,2-6,13H2,1H3,(H,14,15)
InChIKeyOLRRGWNHIODSHS-UHFFFAOYSA-N
MW364.27 g/mol
LogP0.46
Rot. Bonds4

About [5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine

[5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine (PubChem CID 61301039) has the molecular formula C11H18BrN5O2S and a molecular weight of 364.27 g/mol. Its IUPAC name is [5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine
PubChem CID61301039
Molecular FormulaC11H18BrN5O2S
Molecular Weight364.27 g/mol
Exact Mass363.04
IUPAC Name[5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine
SMILESCCN1CCN(S(=O)(=O)c2cc(Br)cnc2NN)CC1
InChIInChI=1S/C11H18BrN5O2S/c1-2-16-3-5-17(6-4-16)20(18,19)10-7-9(12)8-14-11(10)15-13/h7-8H,2-6,13H2,1H3,(H,14,15)
InChIKeyOLRRGWNHIODSHS-UHFFFAOYSA-N
XLogP0.46
TPSA91.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.27
LogP ≤ 50.46
H-Bond Donors ≤ 52
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-3-(4-ethoxypiperidin-1-yl)sulfonyl-2-pyridinyl]hydrazine
CID 61298747
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CID 61300085
1-[(5-bromo-2-hydrazinyl-3-pyridinyl)sulfonyl]-N,N-dimethylpiperidin-4-amine
CID 61298550
1-[1-[(5-bromo-2-hydrazinyl-3-pyridinyl)sulfonyl]piperidin-4-yl]ethanol
CID 106836374
[5-bromo-3-(4-methoxypiperidin-1-yl)sulfonyl-2-pyridinyl]hydrazine
CID 61299120
[5-bromo-3-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-ylsulfonyl)-2-pyridinyl]hydrazine
CID 64576801
5-bromo-3-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]-N-ethylpyridin-2-amine
CID 62147186
(5-bromo-2-hydrazinyl-3-pyridinyl)-(4-ethylpiperazin-1-yl)methanone
CID 62238043
5-bromo-N,N-diethyl-2-hydrazinylpyridine-3-sulfonamide
CID 61298909
[5-bromo-3-(2-ethyl-5-methylpyrrolidin-1-yl)sulfonyl-2-pyridinyl]hydrazine
CID 83218746
1-(4-bromo-2-chlorophenyl)sulfonyl-4-ethylpiperazine
CID 7975709
5-bromo-N-ethyl-3-(4-methylazepan-1-yl)sulfonylpyridin-2-amine
CID 63626897

Frequently Asked Questions

What is the IUPAC name of [5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine?
The IUPAC name of [5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine (CID 61301039) is [5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine?
The canonical SMILES for [5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine is CCN1CCN(S(=O)(=O)c2cc(Br)cnc2NN)CC1.
What is the InChIKey of [5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine?
The InChIKey is OLRRGWNHIODSHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18BrN5O2S/c1-2-16-3-5-17(6-4-16)20(18,19)10-7-9(12)8-14-11(10)15-13/h7-8H,2-6,13H2,1H3,(H,14,15).
What are the key properties of [5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine?
[5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine has a molecular weight of 364.27 g/mol, XLogP of 0.46, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-bromo-3-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine is sourced from PubChem (CID 61301039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).