5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide

C11H17BrN4O2S — CID 64687857

IUPAC5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide
SMILESCC1(NS(=O)(=O)c2cc(Br)cnc2NN)CCCC1
InChIInChI=1S/C11H17BrN4O2S/c1-11(4-2-3-5-11)16-19(17,18)9-6-8(12)7-14-10(9)15-13/h6-7,16H,2-5,13H2,1H3,(H,14,15)
InChIKeyBHKVWWUJTBBRGO-UHFFFAOYSA-N
MW349.25 g/mol
LogP1.74
Rot. Bonds4

About 5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide

5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide (PubChem CID 64687857) has the molecular formula C11H17BrN4O2S and a molecular weight of 349.25 g/mol. Its IUPAC name is 5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide
PubChem CID64687857
Molecular FormulaC11H17BrN4O2S
Molecular Weight349.25 g/mol
Exact Mass348.03
IUPAC Name5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide
SMILESCC1(NS(=O)(=O)c2cc(Br)cnc2NN)CCCC1
InChIInChI=1S/C11H17BrN4O2S/c1-11(4-2-3-5-11)16-19(17,18)9-6-8(12)7-14-10(9)15-13/h6-7,16H,2-5,13H2,1H3,(H,14,15)
InChIKeyBHKVWWUJTBBRGO-UHFFFAOYSA-N
XLogP1.74
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.25
LogP ≤ 51.74
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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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide?
The IUPAC name of 5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide (CID 64687857) is 5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide?
The canonical SMILES for 5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide is CC1(NS(=O)(=O)c2cc(Br)cnc2NN)CCCC1.
What is the InChIKey of 5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide?
The InChIKey is BHKVWWUJTBBRGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17BrN4O2S/c1-11(4-2-3-5-11)16-19(17,18)9-6-8(12)7-14-10(9)15-13/h6-7,16H,2-5,13H2,1H3,(H,14,15).
What are the key properties of 5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide?
5-bromo-2-hydrazinyl-N-(1-methylcyclopentyl)pyridine-3-sulfonamide has a molecular weight of 349.25 g/mol, XLogP of 1.74, 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-(1-methylcyclopentyl)pyridine-3-sulfonamide is sourced from PubChem (CID 64687857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).