4-pyridin-3-ylsulfonylmorpholine

C9H12N2O3S — CID 4276436

IUPAC4-pyridin-3-ylsulfonylmorpholine
SMILESO=S(=O)(c1cccnc1)N1CCOCC1
InChIInChI=1S/C9H12N2O3S/c12-15(13,9-2-1-3-10-8-9)11-4-6-14-7-5-11/h1-3,8H,4-7H2
InChIKeyBYBGTJZHRACDCL-UHFFFAOYSA-N
MW228.27 g/mol
LogP0.10
Rot. Bonds2

About 4-pyridin-3-ylsulfonylmorpholine

4-pyridin-3-ylsulfonylmorpholine (PubChem CID 4276436) has the molecular formula C9H12N2O3S and a molecular weight of 228.27 g/mol. Its IUPAC name is 4-pyridin-3-ylsulfonylmorpholine.

Molecular Properties

Compound Name4-pyridin-3-ylsulfonylmorpholine
PubChem CID4276436
Molecular FormulaC9H12N2O3S
Molecular Weight228.27 g/mol
Exact Mass228.06
IUPAC Name4-pyridin-3-ylsulfonylmorpholine
SMILESO=S(=O)(c1cccnc1)N1CCOCC1
InChIInChI=1S/C9H12N2O3S/c12-15(13,9-2-1-3-10-8-9)11-4-6-14-7-5-11/h1-3,8H,4-7H2
InChIKeyBYBGTJZHRACDCL-UHFFFAOYSA-N
XLogP0.10
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.27
LogP ≤ 50.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-pyridin-3-ylsulfonylmorpholine?
The IUPAC name of 4-pyridin-3-ylsulfonylmorpholine (CID 4276436) is 4-pyridin-3-ylsulfonylmorpholine.
What is the SMILES notation for 4-pyridin-3-ylsulfonylmorpholine?
The canonical SMILES for 4-pyridin-3-ylsulfonylmorpholine is O=S(=O)(c1cccnc1)N1CCOCC1.
What is the InChIKey of 4-pyridin-3-ylsulfonylmorpholine?
The InChIKey is BYBGTJZHRACDCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O3S/c12-15(13,9-2-1-3-10-8-9)11-4-6-14-7-5-11/h1-3,8H,4-7H2.
What are the key properties of 4-pyridin-3-ylsulfonylmorpholine?
4-pyridin-3-ylsulfonylmorpholine has a molecular weight of 228.27 g/mol, XLogP of 0.10, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-3-ylsulfonylmorpholine is sourced from PubChem (CID 4276436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).