3-piperidin-1-ylsulfonylpyridine

C10H14N2O2S — CID 3623948

IUPAC3-piperidin-1-ylsulfonylpyridine
SMILESO=S(=O)(c1cccnc1)N1CCCCC1
InChIInChI=1S/C10H14N2O2S/c13-15(14,10-5-4-6-11-9-10)12-7-2-1-3-8-12/h4-6,9H,1-3,7-8H2
InChIKeyYVNUZIJEPPTRCL-UHFFFAOYSA-N
MW226.30 g/mol
LogP1.26
Rot. Bonds2

About 3-piperidin-1-ylsulfonylpyridine

3-piperidin-1-ylsulfonylpyridine (PubChem CID 3623948) has the molecular formula C10H14N2O2S and a molecular weight of 226.30 g/mol. Its IUPAC name is 3-piperidin-1-ylsulfonylpyridine.

Molecular Properties

Compound Name3-piperidin-1-ylsulfonylpyridine
PubChem CID3623948
Molecular FormulaC10H14N2O2S
Molecular Weight226.30 g/mol
Exact Mass226.08
IUPAC Name3-piperidin-1-ylsulfonylpyridine
SMILESO=S(=O)(c1cccnc1)N1CCCCC1
InChIInChI=1S/C10H14N2O2S/c13-15(14,10-5-4-6-11-9-10)12-7-2-1-3-8-12/h4-6,9H,1-3,7-8H2
InChIKeyYVNUZIJEPPTRCL-UHFFFAOYSA-N
XLogP1.26
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-ylsulfonylpyridine?
The IUPAC name of 3-piperidin-1-ylsulfonylpyridine (CID 3623948) is 3-piperidin-1-ylsulfonylpyridine.
What is the SMILES notation for 3-piperidin-1-ylsulfonylpyridine?
The canonical SMILES for 3-piperidin-1-ylsulfonylpyridine is O=S(=O)(c1cccnc1)N1CCCCC1.
What is the InChIKey of 3-piperidin-1-ylsulfonylpyridine?
The InChIKey is YVNUZIJEPPTRCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2S/c13-15(14,10-5-4-6-11-9-10)12-7-2-1-3-8-12/h4-6,9H,1-3,7-8H2.
What are the key properties of 3-piperidin-1-ylsulfonylpyridine?
3-piperidin-1-ylsulfonylpyridine has a molecular weight of 226.30 g/mol, XLogP of 1.26, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-ylsulfonylpyridine is sourced from PubChem (CID 3623948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).