6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide

C8H12N4O3S — CID 62153010

IUPAC6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide
SMILESCS(=O)(=O)CCNC(=O)c1ccc(N)nn1
InChIInChI=1S/C8H12N4O3S/c1-16(14,15)5-4-10-8(13)6-2-3-7(9)12-11-6/h2-3H,4-5H2,1H3,(H2,9,12)(H,10,13)
InChIKeyMSKGPISCUYKZDM-UHFFFAOYSA-N
MW244.28 g/mol
LogP-1.17
Rot. Bonds4

About 6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide

6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide (PubChem CID 62153010) has the molecular formula C8H12N4O3S and a molecular weight of 244.28 g/mol. Its IUPAC name is 6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide
PubChem CID62153010
Molecular FormulaC8H12N4O3S
Molecular Weight244.28 g/mol
Exact Mass244.06
IUPAC Name6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide
SMILESCS(=O)(=O)CCNC(=O)c1ccc(N)nn1
InChIInChI=1S/C8H12N4O3S/c1-16(14,15)5-4-10-8(13)6-2-3-7(9)12-11-6/h2-3H,4-5H2,1H3,(H2,9,12)(H,10,13)
InChIKeyMSKGPISCUYKZDM-UHFFFAOYSA-N
XLogP-1.17
TPSA115.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.28
LogP ≤ 5-1.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-acetamidoethyl)-6-aminopyridazine-3-carboxamide
CID 62154293
6-amino-N-(2-methylsulfonylethyl)pyridine-2-carboxamide
CID 62240593
6-amino-N-[3-[methyl(propan-2-yl)amino]propyl]pyridazine-3-carboxamide
CID 106050158
6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide
CID 114131484
5-bromo-N-(2-methylsulfonylethyl)pyridine-2-carboxamide
CID 55210079
5-[(Z)-N'-hydroxycarbamimidoyl]-N-(2-methylsulfonylethyl)pyridine-2-carboxamide
CID 55229447
6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide
CID 62186175
6-amino-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide
CID 62152173
N-[2-(ethylsulfamoyl)ethyl]-6-hydrazinylpyridazine-3-carboxamide
CID 106340890
6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide
CID 114175119
3-amino-N-(2-methylsulfonylethyl)pyridine-2-carboxamide
CID 104741450
6-amino-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 62156387

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide (CID 62153010) is 6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide is CS(=O)(=O)CCNC(=O)c1ccc(N)nn1.
What is the InChIKey of 6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide?
The InChIKey is MSKGPISCUYKZDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O3S/c1-16(14,15)5-4-10-8(13)6-2-3-7(9)12-11-6/h2-3H,4-5H2,1H3,(H2,9,12)(H,10,13).
What are the key properties of 6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide?
6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide has a molecular weight of 244.28 g/mol, XLogP of -1.17, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 62153010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).