1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide

C8H13N3O3S — CID 122702079

IUPAC1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide
SMILESCc1ccc(C(O)C(C)S(N)(=O)=O)nn1
InChIInChI=1S/C8H13N3O3S/c1-5-3-4-7(11-10-5)8(12)6(2)15(9,13)14/h3-4,6,8,12H,1-2H3,(H2,9,13,14)
InChIKeyGBIWSEXRAHJSHO-UHFFFAOYSA-N
MW231.28 g/mol
LogP-0.50
Rot. Bonds3

About 1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide

1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide (PubChem CID 122702079) has the molecular formula C8H13N3O3S and a molecular weight of 231.28 g/mol. Its IUPAC name is 1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide.

Molecular Properties

Compound Name1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide
PubChem CID122702079
Molecular FormulaC8H13N3O3S
Molecular Weight231.28 g/mol
Exact Mass231.07
IUPAC Name1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide
SMILESCc1ccc(C(O)C(C)S(N)(=O)=O)nn1
InChIInChI=1S/C8H13N3O3S/c1-5-3-4-7(11-10-5)8(12)6(2)15(9,13)14/h3-4,6,8,12H,1-2H3,(H2,9,13,14)
InChIKeyGBIWSEXRAHJSHO-UHFFFAOYSA-N
XLogP-0.50
TPSA106.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.28
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 53420938
CID 53420938
CID 15275423
CID 15275423
CID 68983941
CID 68983941
CID 71230505
CID 71230505
CID 90227184
CID 90227184
CID 121415111
CID 121415111
CID 121415126
CID 121415126
CID 122458562
CID 122458562
CID 122701590
CID 122701590
CID 124085414
CID 124085414
CID 124085415
CID 124085415
CID 124085416
CID 124085416

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide?
The IUPAC name of 1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide (CID 122702079) is 1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide.
What is the SMILES notation for 1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide?
The canonical SMILES for 1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide is Cc1ccc(C(O)C(C)S(N)(=O)=O)nn1.
What is the InChIKey of 1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide?
The InChIKey is GBIWSEXRAHJSHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O3S/c1-5-3-4-7(11-10-5)8(12)6(2)15(9,13)14/h3-4,6,8,12H,1-2H3,(H2,9,13,14).
What are the key properties of 1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide?
1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide has a molecular weight of 231.28 g/mol, XLogP of -0.50, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-1-(6-methylpyridazin-3-yl)propane-2-sulfonamide is sourced from PubChem (CID 122702079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).