Sulfapyrazine

C10H10N4O2S — CID 8309

IUPAC4-amino-N-pyrazin-2-ylbenzenesulfonamide
SMILESC1=CC(=CC=C1N)S(=O)(=O)NC2=NC=CN=C2
InChIInChI=1S/C10H10N4O2S/c11-8-1-3-9(4-2-8)17(15,16)14-10-7-12-5-6-13-10/h1-7H,11H2,(H,13,14)
InChIKeyYEAICDDXRUOCKJ-UHFFFAOYSA-N
MW250.28 g/mol
LogP0.00
Rot. Bonds3

About Sulfapyrazine

Sulfapyrazine (PubChem CID 8309) has the molecular formula C10H10N4O2S and a molecular weight of 250.28 g/mol. Its IUPAC name is 4-amino-N-pyrazin-2-ylbenzenesulfonamide.

Molecular Properties

Compound NameSulfapyrazine
PubChem CID8309
Molecular FormulaC10H10N4O2S
Molecular Weight250.28 g/mol
Exact Mass250.05
IUPAC Name4-amino-N-pyrazin-2-ylbenzenesulfonamide
SMILESC1=CC(=CC=C1N)S(=O)(=O)NC2=NC=CN=C2
InChIInChI=1S/C10H10N4O2S/c11-8-1-3-9(4-2-8)17(15,16)14-10-7-12-5-6-13-10/h1-7H,11H2,(H,13,14)
InChIKeyYEAICDDXRUOCKJ-UHFFFAOYSA-N
XLogP0.00
TPSA106.00 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity333

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 50.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

Sulfapyridine
CID 5336
Sulfalene
CID 9047
Sulfaquinoxaline
CID 5338
Sulfaquinoxaline Sodium
CID 3693427
Sulfaclozine
CID 66890
Sulfapyridine Sodium
CID 23667654
4-[(6-Chloropyrazin-2-yl)amino]benzenesulfonamide
CID 9994066
4-{[(1H-imidazol-2-yl)methylidene]amino}benzene-1-sulfonamide
CID 135411191
Benzenesulfonamide, n-2-pyridinyl-
CID 261514
Sodium Sulfachloropyrazine Monohydrate
CID 71588002
4-[(3-Amino-2-pyridyl)amino]benzenesulfonamide
CID 28846439
2-Sulfanilamido-5,6-dimethylpyrazine
CID 237857

Frequently Asked Questions

What is the IUPAC name of Sulfapyrazine?
The IUPAC name of Sulfapyrazine (CID 8309) is 4-amino-N-pyrazin-2-ylbenzenesulfonamide.
What is the SMILES notation for Sulfapyrazine?
The canonical SMILES for Sulfapyrazine is C1=CC(=CC=C1N)S(=O)(=O)NC2=NC=CN=C2.
What is the InChIKey of Sulfapyrazine?
The InChIKey is YEAICDDXRUOCKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2S/c11-8-1-3-9(4-2-8)17(15,16)14-10-7-12-5-6-13-10/h1-7H,11H2,(H,13,14).
What are the key properties of Sulfapyrazine?
Sulfapyrazine has a molecular weight of 250.28 g/mol, XLogP of 0.00, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for Sulfapyrazine is sourced from PubChem (CID 8309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).