6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide

C10H12N6O2S — CID 114389293

IUPAC6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)Nc2nccnn2)cn1
InChIInChI=1S/C10H12N6O2S/c1-2-11-9-4-3-8(7-13-9)19(17,18)16-10-12-5-6-14-15-10/h3-7H,2H2,1H3,(H,11,13)(H,12,15,16)
InChIKeyCXHQVQFIISZJJY-UHFFFAOYSA-N
MW280.31 g/mol
LogP0.50
Rot. Bonds5

About 6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide

6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide (PubChem CID 114389293) has the molecular formula C10H12N6O2S and a molecular weight of 280.31 g/mol. Its IUPAC name is 6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide
PubChem CID114389293
Molecular FormulaC10H12N6O2S
Molecular Weight280.31 g/mol
Exact Mass280.07
IUPAC Name6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)Nc2nccnn2)cn1
InChIInChI=1S/C10H12N6O2S/c1-2-11-9-4-3-8(7-13-9)19(17,18)16-10-12-5-6-14-15-10/h3-7H,2H2,1H3,(H,11,13)(H,12,15,16)
InChIKeyCXHQVQFIISZJJY-UHFFFAOYSA-N
XLogP0.50
TPSA109.76 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.31
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787805
6-(ethylamino)-N-methylpyridine-3-sulfonamide
CID 62150384
6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide
CID 79043938
6-(ethylamino)-N-(4-fluorophenyl)pyridine-3-sulfonamide
CID 62145209
6-(ethylamino)-N-(2-methylphenyl)pyridine-3-sulfonamide
CID 62143880
6-(propylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787796
6-(ethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-sulfonamide
CID 62150311
2-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide
CID 114389289
N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide
CID 62147032
N-(4-cyanophenyl)-6-(ethylamino)pyridine-3-sulfonamide
CID 62144186
N-(2,5-dimethylpyrazol-3-yl)-6-(ethylamino)pyridine-3-sulfonamide
CID 62145254
N-(2,2-dimethylbutyl)-6-(ethylamino)pyridine-3-sulfonamide
CID 103464350

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide (CID 114389293) is 6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide is CCNc1ccc(S(=O)(=O)Nc2nccnn2)cn1.
What is the InChIKey of 6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide?
The InChIKey is CXHQVQFIISZJJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O2S/c1-2-11-9-4-3-8(7-13-9)19(17,18)16-10-12-5-6-14-15-10/h3-7H,2H2,1H3,(H,11,13)(H,12,15,16).
What are the key properties of 6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide?
6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide has a molecular weight of 280.31 g/mol, XLogP of 0.50, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 114389293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).