2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide

C14H17N3O3S2 — CID 133379318

IUPAC2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide
SMILESCC1CN(c2ncccc2S(N)(=O)=O)CC(c2ccsc2)O1
InChIInChI=1S/C14H17N3O3S2/c1-10-7-17(8-12(20-10)11-4-6-21-9-11)14-13(22(15,18)19)3-2-5-16-14/h2-6,9-10,12H,7-8H2,1H3,(H2,15,18,19)
InChIKeyGZAJEVPSMLESHT-UHFFFAOYSA-N
MW339.44 g/mol
LogP1.76
Rot. Bonds3

About 2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide

2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide (PubChem CID 133379318) has the molecular formula C14H17N3O3S2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide
PubChem CID133379318
Molecular FormulaC14H17N3O3S2
Molecular Weight339.44 g/mol
Exact Mass339.07
IUPAC Name2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide
SMILESCC1CN(c2ncccc2S(N)(=O)=O)CC(c2ccsc2)O1
InChIInChI=1S/C14H17N3O3S2/c1-10-7-17(8-12(20-10)11-4-6-21-9-11)14-13(22(15,18)19)3-2-5-16-14/h2-6,9-10,12H,7-8H2,1H3,(H2,15,18,19)
InChIKeyGZAJEVPSMLESHT-UHFFFAOYSA-N
XLogP1.76
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide?
The IUPAC name of 2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide (CID 133379318) is 2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide?
The canonical SMILES for 2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide is CC1CN(c2ncccc2S(N)(=O)=O)CC(c2ccsc2)O1.
What is the InChIKey of 2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide?
The InChIKey is GZAJEVPSMLESHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3S2/c1-10-7-17(8-12(20-10)11-4-6-21-9-11)14-13(22(15,18)19)3-2-5-16-14/h2-6,9-10,12H,7-8H2,1H3,(H2,15,18,19).
What are the key properties of 2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide?
2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide has a molecular weight of 339.44 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 133379318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).