2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide

C7H9N3O3S2 — CID 46907400

IUPAC2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide
SMILESNC(=O)CSc1ccncc1S(N)(=O)=O
InChIInChI=1S/C7H9N3O3S2/c8-7(11)4-14-5-1-2-10-3-6(5)15(9,12)13/h1-3H,4H2,(H2,8,11)(H2,9,12,13)
InChIKeyGMEZLQXYYUCJAQ-UHFFFAOYSA-N
MW247.30 g/mol
LogP-0.69
Rot. Bonds4

About 2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide

2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide (PubChem CID 46907400) has the molecular formula C7H9N3O3S2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide.

Molecular Properties

Compound Name2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide
PubChem CID46907400
Molecular FormulaC7H9N3O3S2
Molecular Weight247.30 g/mol
Exact Mass247.01
IUPAC Name2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide
SMILESNC(=O)CSc1ccncc1S(N)(=O)=O
InChIInChI=1S/C7H9N3O3S2/c8-7(11)4-14-5-1-2-10-3-6(5)15(9,12)13/h1-3H,4H2,(H2,8,11)(H2,9,12,13)
InChIKeyGMEZLQXYYUCJAQ-UHFFFAOYSA-N
XLogP-0.69
TPSA116.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 5-0.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide?
The IUPAC name of 2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide (CID 46907400) is 2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide.
What is the SMILES notation for 2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide?
The canonical SMILES for 2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide is NC(=O)CSc1ccncc1S(N)(=O)=O.
What is the InChIKey of 2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide?
The InChIKey is GMEZLQXYYUCJAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O3S2/c8-7(11)4-14-5-1-2-10-3-6(5)15(9,12)13/h1-3H,4H2,(H2,8,11)(H2,9,12,13).
What are the key properties of 2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide?
2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide has a molecular weight of 247.30 g/mol, XLogP of -0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-sulfamoyl-4-pyridinyl)sulfanyl]acetamide is sourced from PubChem (CID 46907400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).