6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide

C10H9ClN4O2S — CID 106833700

IUPAC6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NCc1cccnn1)c1ccc(Cl)nc1
InChIInChI=1S/C10H9ClN4O2S/c11-10-4-3-9(7-12-10)18(16,17)14-6-8-2-1-5-13-15-8/h1-5,7,14H,6H2
InChIKeyJYJFIRADIMRHBA-UHFFFAOYSA-N
MW284.73 g/mol
LogP1.00
Rot. Bonds4

About 6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide

6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide (PubChem CID 106833700) has the molecular formula C10H9ClN4O2S and a molecular weight of 284.73 g/mol. Its IUPAC name is 6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide
PubChem CID106833700
Molecular FormulaC10H9ClN4O2S
Molecular Weight284.73 g/mol
Exact Mass284.01
IUPAC Name6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NCc1cccnn1)c1ccc(Cl)nc1
InChIInChI=1S/C10H9ClN4O2S/c11-10-4-3-9(7-12-10)18(16,17)14-6-8-2-1-5-13-15-8/h1-5,7,14H,6H2
InChIKeyJYJFIRADIMRHBA-UHFFFAOYSA-N
XLogP1.00
TPSA84.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.73
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide
CID 106896703
N-(pyridazin-3-ylmethyl)benzenesulfonamide
CID 106833682
6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide
CID 106897421
6-chloro-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyridine-3-sulfonamide
CID 35387073
4-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzenesulfonamide
CID 106089546
2-(methylamino)-N-(pyridazin-3-ylmethyl)pyridine-4-sulfonamide
CID 106897636
6-chloro-N-[(4-chlorophenyl)methyl]pyridine-3-sulfonamide
CID 826869
6-chloro-N-(2-hydroxyethyl)pyridine-3-sulfonamide
CID 4862052
6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-carboxamide
CID 106832257
4-(3-aminoprop-1-ynyl)-N-(pyridazin-3-ylmethyl)benzenesulfonamide
CID 106897525
6-chloro-N-[3-[(6-chloro-3-pyridinyl)sulfonylamino]propyl]pyridine-3-sulfonamide
CID 4729949
4-amino-3-nitro-N-(pyridazin-3-ylmethyl)benzenesulfonamide
CID 106896781

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide?
The IUPAC name of 6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide (CID 106833700) is 6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide is O=S(=O)(NCc1cccnn1)c1ccc(Cl)nc1.
What is the InChIKey of 6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide?
The InChIKey is JYJFIRADIMRHBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN4O2S/c11-10-4-3-9(7-12-10)18(16,17)14-6-8-2-1-5-13-15-8/h1-5,7,14H,6H2.
What are the key properties of 6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide?
6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide has a molecular weight of 284.73 g/mol, XLogP of 1.00, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 106833700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).