6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide

C12H11ClN4O3S — CID 61052794

IUPAC6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide
SMILESCc1ccc(S(N)(=O)=O)cc1NC(=O)c1ccc(Cl)nn1
InChIInChI=1S/C12H11ClN4O3S/c1-7-2-3-8(21(14,19)20)6-10(7)15-12(18)9-4-5-11(13)17-16-9/h2-6H,1H3,(H,15,18)(H2,14,19,20)
InChIKeyVCPNRGRAMLBNEJ-UHFFFAOYSA-N
MW326.77 g/mol
LogP1.34
Rot. Bonds3

About 6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide

6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide (PubChem CID 61052794) has the molecular formula C12H11ClN4O3S and a molecular weight of 326.77 g/mol. Its IUPAC name is 6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide
PubChem CID61052794
Molecular FormulaC12H11ClN4O3S
Molecular Weight326.77 g/mol
Exact Mass326.02
IUPAC Name6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide
SMILESCc1ccc(S(N)(=O)=O)cc1NC(=O)c1ccc(Cl)nn1
InChIInChI=1S/C12H11ClN4O3S/c1-7-2-3-8(21(14,19)20)6-10(7)15-12(18)9-4-5-11(13)17-16-9/h2-6H,1H3,(H,15,18)(H2,14,19,20)
InChIKeyVCPNRGRAMLBNEJ-UHFFFAOYSA-N
XLogP1.34
TPSA115.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.77
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 5211673
3-chloro-4-methyl-N-(2-methyl-5-sulfamoylphenyl)thiophene-2-carboxamide
CID 103405078
(2-methyl-5-sulfamoylphenyl)thiourea
CID 169356925
2-hydroxy-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 61129726
ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate
CID 61063184
6-chloro-N-(2,5-dimethyl-4-nitrophenyl)pyridazine-3-carboxamide
CID 103145316
3-amino-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 43710895
N-(2-chloro-5-sulfamoylphenyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 61128987
4-chloro-N-(2-methyl-5-sulfamoylphenyl)-3-nitrobenzamide
CID 4547924
2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide
CID 55103402
5-bromo-4-methyl-N-(2-methyl-5-sulfamoylphenyl)thiophene-2-carboxamide
CID 79999800
3-fluoro-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 4155198

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide (CID 61052794) is 6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide is Cc1ccc(S(N)(=O)=O)cc1NC(=O)c1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide?
The InChIKey is VCPNRGRAMLBNEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN4O3S/c1-7-2-3-8(21(14,19)20)6-10(7)15-12(18)9-4-5-11(13)17-16-9/h2-6H,1H3,(H,15,18)(H2,14,19,20).
What are the key properties of 6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide?
6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide has a molecular weight of 326.77 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 61052794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).