N-methylsulfonylpyridazine-4-carboxamide

C6H7N3O3S — CID 130725112

IUPACN-methylsulfonylpyridazine-4-carboxamide
SMILESCS(=O)(=O)NC(=O)c1ccnnc1
InChIInChI=1S/C6H7N3O3S/c1-13(11,12)9-6(10)5-2-3-7-8-4-5/h2-4H,1H3,(H,9,10)
InChIKeyMPJAJTGZZPJBIP-UHFFFAOYSA-N
MW201.21 g/mol
LogP-0.83
Rot. Bonds2

About N-methylsulfonylpyridazine-4-carboxamide

N-methylsulfonylpyridazine-4-carboxamide (PubChem CID 130725112) has the molecular formula C6H7N3O3S and a molecular weight of 201.21 g/mol. Its IUPAC name is N-methylsulfonylpyridazine-4-carboxamide.

Molecular Properties

Compound NameN-methylsulfonylpyridazine-4-carboxamide
PubChem CID130725112
Molecular FormulaC6H7N3O3S
Molecular Weight201.21 g/mol
Exact Mass201.02
IUPAC NameN-methylsulfonylpyridazine-4-carboxamide
SMILESCS(=O)(=O)NC(=O)c1ccnnc1
InChIInChI=1S/C6H7N3O3S/c1-13(11,12)9-6(10)5-2-3-7-8-4-5/h2-4H,1H3,(H,9,10)
InChIKeyMPJAJTGZZPJBIP-UHFFFAOYSA-N
XLogP-0.83
TPSA89.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.21
LogP ≤ 5-0.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-propan-2-ylpyridazine-4-carboxamide
CID 115736010
pyridazine-4-carbohydrazide;hydrochloride
CID 122236542
N-(2-sulfamoylethyl)pyridazine-4-carboxamide
CID 115769360
methyl [5-(methylsulfonylcarbamoyl)-2-pyridinyl] carbonate
CID 67749491
N-(3-methylazetidin-3-yl)pyridazine-4-carboxamide
CID 130913746
N-(2-methoxyethyl)pyridazine-4-carboxamide
CID 143705997
N-[(1S,5S,6R,7S)-7-(methanesulfonamido)-2-oxabicyclo[3.2.0]heptan-6-yl]pyridazine-4-carboxamide
CID 133267982
N-(5-methyl-1H-pyrazol-3-yl)pyridazine-4-carboxamide
CID 115736164
3-methyl-4-(pyridazine-4-carbonylamino)benzoic acid
CID 113352863
N-(1-chloropropan-2-yl)pyridazine-4-carboxamide
CID 104672603
(pyridazine-4-carbonylamino)thiourea
CID 104672951
N-(1-ethylsulfonylpiperidin-4-yl)pyridazine-4-carboxamide
CID 127667132

Frequently Asked Questions

What is the IUPAC name of N-methylsulfonylpyridazine-4-carboxamide?
The IUPAC name of N-methylsulfonylpyridazine-4-carboxamide (CID 130725112) is N-methylsulfonylpyridazine-4-carboxamide.
What is the SMILES notation for N-methylsulfonylpyridazine-4-carboxamide?
The canonical SMILES for N-methylsulfonylpyridazine-4-carboxamide is CS(=O)(=O)NC(=O)c1ccnnc1.
What is the InChIKey of N-methylsulfonylpyridazine-4-carboxamide?
The InChIKey is MPJAJTGZZPJBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O3S/c1-13(11,12)9-6(10)5-2-3-7-8-4-5/h2-4H,1H3,(H,9,10).
What are the key properties of N-methylsulfonylpyridazine-4-carboxamide?
N-methylsulfonylpyridazine-4-carboxamide has a molecular weight of 201.21 g/mol, XLogP of -0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylsulfonylpyridazine-4-carboxamide is sourced from PubChem (CID 130725112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).