4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide

C10H12N6O2S — CID 114389263

IUPAC4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide
SMILESCc1nnc(NS(=O)(=O)c2cnccc2N)nc1C
InChIInChI=1S/C10H12N6O2S/c1-6-7(2)14-15-10(13-6)16-19(17,18)9-5-12-4-3-8(9)11/h3-5H,1-2H3,(H2,11,12)(H,13,15,16)
InChIKeyWWDAFHYBANKKKR-UHFFFAOYSA-N
MW280.31 g/mol
LogP0.27
Rot. Bonds3

About 4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide

4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide (PubChem CID 114389263) has the molecular formula C10H12N6O2S and a molecular weight of 280.31 g/mol. Its IUPAC name is 4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide
PubChem CID114389263
Molecular FormulaC10H12N6O2S
Molecular Weight280.31 g/mol
Exact Mass280.07
IUPAC Name4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide
SMILESCc1nnc(NS(=O)(=O)c2cnccc2N)nc1C
InChIInChI=1S/C10H12N6O2S/c1-6-7(2)14-15-10(13-6)16-19(17,18)9-5-12-4-3-8(9)11/h3-5H,1-2H3,(H2,11,12)(H,13,15,16)
InChIKeyWWDAFHYBANKKKR-UHFFFAOYSA-N
XLogP0.27
TPSA123.75 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.31
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

3-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-2-sulfonamide
CID 103307784
3-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)-2,4-difluorobenzenesulfonamide
CID 107343922
5-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)-2-fluorobenzenesulfonamide
CID 114386821
4-amino-2-bromo-N-(5,6-dimethyl-1,2,4-triazin-3-yl)benzenesulfonamide
CID 114386867
4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)-2-fluorobenzenesulfonamide
CID 114386828
2-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyrimidine-5-sulfonamide
CID 114389265
2-(aminomethyl)-N-(5,6-dimethyl-1,2,4-triazin-3-yl)thiophene-3-sulfonamide
CID 106082978
5-(aminomethyl)-N-(5,6-dimethyl-1,2,4-triazin-3-yl)-2-fluorobenzenesulfonamide
CID 106082976
3-amino-4-chloro-N-(5,6-dimethyl-1,2,4-triazin-3-yl)benzenesulfonamide
CID 114386803
3-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)-1-ethylpyrazole-4-sulfonamide
CID 114386852
2,5-dibromo-N-(5,6-dimethyl-1,2,4-triazin-3-yl)benzenesulfonamide
CID 114389114
4-amino-N-[(propan-2-ylamino)methyl]pyridine-3-sulfonamide
CID 88944337

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide?
The IUPAC name of 4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide (CID 114389263) is 4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide?
The canonical SMILES for 4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide is Cc1nnc(NS(=O)(=O)c2cnccc2N)nc1C.
What is the InChIKey of 4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide?
The InChIKey is WWDAFHYBANKKKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O2S/c1-6-7(2)14-15-10(13-6)16-19(17,18)9-5-12-4-3-8(9)11/h3-5H,1-2H3,(H2,11,12)(H,13,15,16).
What are the key properties of 4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide?
4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide has a molecular weight of 280.31 g/mol, XLogP of 0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 114389263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).