6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide

C9H13ClN4O3S — CID 114175119

IUPAC6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide
SMILESCN(C)S(=O)(=O)CCNC(=O)c1ccc(Cl)nn1
InChIInChI=1S/C9H13ClN4O3S/c1-14(2)18(16,17)6-5-11-9(15)7-3-4-8(10)13-12-7/h3-4H,5-6H2,1-2H3,(H,11,15)
InChIKeyIQDXIIAVHKXSLC-UHFFFAOYSA-N
MW292.75 g/mol
LogP-0.25
Rot. Bonds5

About 6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide

6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide (PubChem CID 114175119) has the molecular formula C9H13ClN4O3S and a molecular weight of 292.75 g/mol. Its IUPAC name is 6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide
PubChem CID114175119
Molecular FormulaC9H13ClN4O3S
Molecular Weight292.75 g/mol
Exact Mass292.04
IUPAC Name6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide
SMILESCN(C)S(=O)(=O)CCNC(=O)c1ccc(Cl)nn1
InChIInChI=1S/C9H13ClN4O3S/c1-14(2)18(16,17)6-5-11-9(15)7-3-4-8(10)13-12-7/h3-4H,5-6H2,1-2H3,(H,11,15)
InChIKeyIQDXIIAVHKXSLC-UHFFFAOYSA-N
XLogP-0.25
TPSA92.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.75
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-N-[2-(dimethylamino)ethyl]pyridazine-3-carboxamide
CID 60859027
6-chloro-N-[2-[methyl(propan-2-yl)amino]ethyl]pyridazine-3-carboxamide
CID 55101967
6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridine-3-carboxamide
CID 114175120
6-chloro-N-[3-[ethyl(methylsulfonyl)amino]propyl]pyridazine-3-carboxamide
CID 61053648
2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide
CID 106339733
N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide
CID 106342692
4-[2-(dimethylsulfamoyl)ethylcarbamoyl]benzoic acid
CID 106341849
4-chloro-N-[2-(dimethylsulfamoyl)ethyl]-2-hydroxybenzamide
CID 106339696
6-chloropyridazine-3-carbohydrazide
CID 10080848
6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide
CID 62153010
6-chloro-N-(2-cyclobutylethyl)pyridazine-3-carboxamide
CID 86026045
1-(2-aminoethyl)-N-[2-(dimethylsulfamoyl)ethyl]triazole-4-carboxamide
CID 106337535

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide (CID 114175119) is 6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide is CN(C)S(=O)(=O)CCNC(=O)c1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide?
The InChIKey is IQDXIIAVHKXSLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClN4O3S/c1-14(2)18(16,17)6-5-11-9(15)7-3-4-8(10)13-12-7/h3-4H,5-6H2,1-2H3,(H,11,15).
What are the key properties of 6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide?
6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide has a molecular weight of 292.75 g/mol, XLogP of -0.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide is sourced from PubChem (CID 114175119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).