6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide

C10H10N4O3S — CID 106897421

IUPAC6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide
SMILESO=c1ccc(S(=O)(=O)NCc2cccnn2)c[nH]1
InChIInChI=1S/C10H10N4O3S/c15-10-4-3-9(7-11-10)18(16,17)13-6-8-2-1-5-12-14-8/h1-5,7,13H,6H2,(H,11,15)
InChIKeyBZOPSHXSIBRTFW-UHFFFAOYSA-N
MW266.28 g/mol
LogP-0.36
Rot. Bonds4

About 6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide

6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide (PubChem CID 106897421) has the molecular formula C10H10N4O3S and a molecular weight of 266.28 g/mol. Its IUPAC name is 6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide
PubChem CID106897421
Molecular FormulaC10H10N4O3S
Molecular Weight266.28 g/mol
Exact Mass266.05
IUPAC Name6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide
SMILESO=c1ccc(S(=O)(=O)NCc2cccnn2)c[nH]1
InChIInChI=1S/C10H10N4O3S/c15-10-4-3-9(7-11-10)18(16,17)13-6-8-2-1-5-12-14-8/h1-5,7,13H,6H2,(H,11,15)
InChIKeyBZOPSHXSIBRTFW-UHFFFAOYSA-N
XLogP-0.36
TPSA104.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(pyridazin-3-ylmethyl)benzenesulfonamide
CID 106833682
6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide
CID 106833700
6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridine-3-sulfonamide
CID 106896703
N-[(2-hydroxyphenyl)methyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 114332748
4-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzenesulfonamide
CID 106089546
N-(pyridazin-3-ylmethyl)-1H-pyrazole-5-sulfonamide
CID 106897420
4-(3-aminoprop-1-ynyl)-N-(pyridazin-3-ylmethyl)benzenesulfonamide
CID 106897525
N-[(2-chlorophenyl)methyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 43629113
N-[(5-ethylthiophen-2-yl)methyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 106011806
4-fluoro-3-(methylaminomethyl)-N-(pyridazin-3-ylmethyl)benzenesulfonamide
CID 106089510
4-amino-3-nitro-N-(pyridazin-3-ylmethyl)benzenesulfonamide
CID 106896781
2-(methylamino)-N-(pyridazin-3-ylmethyl)pyridine-4-sulfonamide
CID 106897636

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide?
The IUPAC name of 6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide (CID 106897421) is 6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide.
What is the SMILES notation for 6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide?
The canonical SMILES for 6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide is O=c1ccc(S(=O)(=O)NCc2cccnn2)c[nH]1.
What is the InChIKey of 6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide?
The InChIKey is BZOPSHXSIBRTFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3S/c15-10-4-3-9(7-11-10)18(16,17)13-6-8-2-1-5-12-14-8/h1-5,7,13H,6H2,(H,11,15).
What are the key properties of 6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide?
6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide has a molecular weight of 266.28 g/mol, XLogP of -0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-(pyridazin-3-ylmethyl)-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 106897421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).