N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide

C14H16N4O3S — CID 2999131

IUPACN-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCOCC2)nn1)c1ccccc1
InChIInChI=1S/C14H16N4O3S/c19-22(20,12-4-2-1-3-5-12)17-13-6-7-14(16-15-13)18-8-10-21-11-9-18/h1-7H,8-11H2,(H,15,17)
InChIKeyOXQQUABXROAUOP-UHFFFAOYSA-N
MW320.37 g/mol
LogP1.11
Rot. Bonds4

About N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide

N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide (PubChem CID 2999131) has the molecular formula C14H16N4O3S and a molecular weight of 320.37 g/mol. Its IUPAC name is N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide
PubChem CID2999131
Molecular FormulaC14H16N4O3S
Molecular Weight320.37 g/mol
Exact Mass320.09
IUPAC NameN-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCOCC2)nn1)c1ccccc1
InChIInChI=1S/C14H16N4O3S/c19-22(20,12-4-2-1-3-5-12)17-13-6-7-14(16-15-13)18-8-10-21-11-9-18/h1-7H,8-11H2,(H,15,17)
InChIKeyOXQQUABXROAUOP-UHFFFAOYSA-N
XLogP1.11
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide
CID 113043896
2,4-dimethoxy-N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide
CID 113039736
N-(6-morpholin-4-ylpyridazin-3-yl)-2-phenylacetamide
CID 113039672
2-chloro-N-(6-piperidin-1-ylpyridazin-3-yl)benzenesulfonamide
CID 113039063
2-methoxy-5-methyl-N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide
CID 113039734
5-chloro-2-methoxy-N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide
CID 113039759
N-[6-(azepan-1-yl)pyridazin-3-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 113045406
N-(6-morpholin-4-ylpyridazin-3-yl)-3,3-diphenylpropanamide
CID 113039669
N-(2,5-dimethylpyrrol-1-yl)-6-morpholin-4-ylpyridazin-3-amine;hydron;chloride
CID 50986718
N-[6-(3,4-dihydro-1H-isoquinolin-2-yl)pyridazin-3-yl]-4-fluorobenzenesulfonamide
CID 113042471
4-ethoxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide
CID 113038808
4-chloro-N-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]benzenesulfonamide
CID 113039262

Frequently Asked Questions

What is the IUPAC name of N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide?
The IUPAC name of N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide (CID 2999131) is N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide.
What is the SMILES notation for N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide?
The canonical SMILES for N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide is O=S(=O)(Nc1ccc(N2CCOCC2)nn1)c1ccccc1.
What is the InChIKey of N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide?
The InChIKey is OXQQUABXROAUOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3S/c19-22(20,12-4-2-1-3-5-12)17-13-6-7-14(16-15-13)18-8-10-21-11-9-18/h1-7H,8-11H2,(H,15,17).
What are the key properties of N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide?
N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide has a molecular weight of 320.37 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide is sourced from PubChem (CID 2999131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).