5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide

C11H15ClN6O2S — CID 64607395

IUPAC5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide
SMILESCC(C)n1nccc1NS(=O)(=O)c1cnc(NN)c(Cl)c1
InChIInChI=1S/C11H15ClN6O2S/c1-7(2)18-10(3-4-15-18)17-21(19,20)8-5-9(12)11(16-13)14-6-8/h3-7,17H,13H2,1-2H3,(H,14,16)
InChIKeyPLRQEHXVMNPADK-UHFFFAOYSA-N
MW330.80 g/mol
LogP1.60
Rot. Bonds5

About 5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide

5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide (PubChem CID 64607395) has the molecular formula C11H15ClN6O2S and a molecular weight of 330.80 g/mol. Its IUPAC name is 5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide
PubChem CID64607395
Molecular FormulaC11H15ClN6O2S
Molecular Weight330.80 g/mol
Exact Mass330.07
IUPAC Name5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide
SMILESCC(C)n1nccc1NS(=O)(=O)c1cnc(NN)c(Cl)c1
InChIInChI=1S/C11H15ClN6O2S/c1-7(2)18-10(3-4-15-18)17-21(19,20)8-5-9(12)11(16-13)14-6-8/h3-7,17H,13H2,1-2H3,(H,14,16)
InChIKeyPLRQEHXVMNPADK-UHFFFAOYSA-N
XLogP1.60
TPSA114.93 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.80
LogP ≤ 51.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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-chloro-6-hydrazinyl-N-pyrimidin-2-ylpyridine-3-sulfonamide
CID 64608544
5-chloro-6-hydrazinyl-N-(4-methylsulfanylphenyl)pyridine-3-sulfonamide
CID 64607396
5-chloro-6-hydrazinyl-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide
CID 79240791
5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide
CID 65486622
5-chloro-N-(2-chloro-4-methylphenyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64608552
N-(4-bromophenyl)-5-chloro-6-hydrazinylpyridine-3-sulfonamide
CID 64607594
2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide
CID 64607030
5-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787298
3-(1-aminoethyl)-N-(2-propan-2-ylpyrazol-3-yl)benzenesulfonamide
CID 43107586
5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64608935
5-chloro-6-hydrazinyl-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide
CID 114388272
5-chloro-N-(2-ethylphenyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64609120

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide?
The IUPAC name of 5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide (CID 64607395) is 5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide is CC(C)n1nccc1NS(=O)(=O)c1cnc(NN)c(Cl)c1.
What is the InChIKey of 5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide?
The InChIKey is PLRQEHXVMNPADK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN6O2S/c1-7(2)18-10(3-4-15-18)17-21(19,20)8-5-9(12)11(16-13)14-6-8/h3-7,17H,13H2,1-2H3,(H,14,16).
What are the key properties of 5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide?
5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide has a molecular weight of 330.80 g/mol, XLogP of 1.60, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 64607395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).