2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine

C13H13N3O3S — CID 122247345

IUPAC2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine
SMILESO=S(=O)(c1cccnc1)N1CC(Oc2ccccn2)C1
InChIInChI=1S/C13H13N3O3S/c17-20(18,12-4-3-6-14-8-12)16-9-11(10-16)19-13-5-1-2-7-15-13/h1-8,11H,9-10H2
InChIKeyCXMPEWNNVRJCFY-UHFFFAOYSA-N
MW291.33 g/mol
LogP0.93
Rot. Bonds4

About 2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine

2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine (PubChem CID 122247345) has the molecular formula C13H13N3O3S and a molecular weight of 291.33 g/mol. Its IUPAC name is 2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine.

Molecular Properties

Compound Name2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine
PubChem CID122247345
Molecular FormulaC13H13N3O3S
Molecular Weight291.33 g/mol
Exact Mass291.07
IUPAC Name2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine
SMILESO=S(=O)(c1cccnc1)N1CC(Oc2ccccn2)C1
InChIInChI=1S/C13H13N3O3S/c17-20(18,12-4-3-6-14-8-12)16-9-11(10-16)19-13-5-1-2-7-15-13/h1-8,11H,9-10H2
InChIKeyCXMPEWNNVRJCFY-UHFFFAOYSA-N
XLogP0.93
TPSA72.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine?
The IUPAC name of 2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine (CID 122247345) is 2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine.
What is the SMILES notation for 2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine?
The canonical SMILES for 2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine is O=S(=O)(c1cccnc1)N1CC(Oc2ccccn2)C1.
What is the InChIKey of 2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine?
The InChIKey is CXMPEWNNVRJCFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O3S/c17-20(18,12-4-3-6-14-8-12)16-9-11(10-16)19-13-5-1-2-7-15-13/h1-8,11H,9-10H2.
What are the key properties of 2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine?
2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine has a molecular weight of 291.33 g/mol, XLogP of 0.93, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine is sourced from PubChem (CID 122247345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).