6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide

C11H13N5O2S — CID 116787805

IUPAC6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)Nc2cccnn2)cn1
InChIInChI=1S/C11H13N5O2S/c1-2-12-10-6-5-9(8-13-10)19(17,18)16-11-4-3-7-14-15-11/h3-8H,2H2,1H3,(H,12,13)(H,15,16)
InChIKeyHQRCIIJQISRJKF-UHFFFAOYSA-N
MW279.32 g/mol
LogP1.10
Rot. Bonds5

About 6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide

6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide (PubChem CID 116787805) has the molecular formula C11H13N5O2S and a molecular weight of 279.32 g/mol. Its IUPAC name is 6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
PubChem CID116787805
Molecular FormulaC11H13N5O2S
Molecular Weight279.32 g/mol
Exact Mass279.08
IUPAC Name6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)Nc2cccnn2)cn1
InChIInChI=1S/C11H13N5O2S/c1-2-12-10-6-5-9(8-13-10)19(17,18)16-11-4-3-7-14-15-11/h3-8H,2H2,1H3,(H,12,13)(H,15,16)
InChIKeyHQRCIIJQISRJKF-UHFFFAOYSA-N
XLogP1.10
TPSA96.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.32
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(propylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787796
6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide
CID 114389293
6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide
CID 79043938
6-(ethylamino)-N-methylpyridine-3-sulfonamide
CID 62150384
6-(ethylamino)-N-(2-methylphenyl)pyridine-3-sulfonamide
CID 62143880
4-methyl-N-pyridazin-3-ylbenzenesulfonamide
CID 118115921
6-(ethylamino)-N-(4-fluorophenyl)pyridine-3-sulfonamide
CID 62145209
N-(2,5-dimethylpyrazol-3-yl)-6-(ethylamino)pyridine-3-sulfonamide
CID 62145254
5-bromo-2-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787807
N-(2,3-dichlorophenyl)-6-(ethylamino)pyridine-3-sulfonamide
CID 62149087
6-(ethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-sulfonamide
CID 62150311
N-(4-cyanophenyl)-6-(ethylamino)pyridine-3-sulfonamide
CID 62144186

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide?
The IUPAC name of 6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide (CID 116787805) is 6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide.
What is the SMILES notation for 6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide?
The canonical SMILES for 6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide is CCNc1ccc(S(=O)(=O)Nc2cccnn2)cn1.
What is the InChIKey of 6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide?
The InChIKey is HQRCIIJQISRJKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O2S/c1-2-12-10-6-5-9(8-13-10)19(17,18)16-11-4-3-7-14-15-11/h3-8H,2H2,1H3,(H,12,13)(H,15,16).
What are the key properties of 6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide?
6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide has a molecular weight of 279.32 g/mol, XLogP of 1.10, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide is sourced from PubChem (CID 116787805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).