3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide

C10H15N3O2S2 — CID 103304503

IUPAC3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide
SMILESCN(C1CCSC1)S(=O)(=O)c1ncccc1N
InChIInChI=1S/C10H15N3O2S2/c1-13(8-4-6-16-7-8)17(14,15)10-9(11)3-2-5-12-10/h2-3,5,8H,4,6-7,11H2,1H3
InChIKeyQBMWHUAXEJRQPS-UHFFFAOYSA-N
MW273.38 g/mol
LogP0.79
Rot. Bonds3

About 3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide

3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide (PubChem CID 103304503) has the molecular formula C10H15N3O2S2 and a molecular weight of 273.38 g/mol. Its IUPAC name is 3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide
PubChem CID103304503
Molecular FormulaC10H15N3O2S2
Molecular Weight273.38 g/mol
Exact Mass273.06
IUPAC Name3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide
SMILESCN(C1CCSC1)S(=O)(=O)c1ncccc1N
InChIInChI=1S/C10H15N3O2S2/c1-13(8-4-6-16-7-8)17(14,15)10-9(11)3-2-5-12-10/h2-3,5,8H,4,6-7,11H2,1H3
InChIKeyQBMWHUAXEJRQPS-UHFFFAOYSA-N
XLogP0.79
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide?
The IUPAC name of 3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide (CID 103304503) is 3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide?
The canonical SMILES for 3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide is CN(C1CCSC1)S(=O)(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide?
The InChIKey is QBMWHUAXEJRQPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S2/c1-13(8-4-6-16-7-8)17(14,15)10-9(11)3-2-5-12-10/h2-3,5,8H,4,6-7,11H2,1H3.
What are the key properties of 3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide?
3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide has a molecular weight of 273.38 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-N-(thiolan-3-yl)pyridine-2-sulfonamide is sourced from PubChem (CID 103304503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).