1-morpholin-4-ylsulfonylpiperidin-4-amine

C9H19N3O3S — CID 28783155

IUPAC1-morpholin-4-ylsulfonylpiperidin-4-amine
SMILESNC1CCN(S(=O)(=O)N2CCOCC2)CC1
InChIInChI=1S/C9H19N3O3S/c10-9-1-3-11(4-2-9)16(13,14)12-5-7-15-8-6-12/h9H,1-8,10H2
InChIKeyXYSKGGIRUYMGEO-UHFFFAOYSA-N
MW249.34 g/mol
LogP-1.01
Rot. Bonds2

About 1-morpholin-4-ylsulfonylpiperidin-4-amine

1-morpholin-4-ylsulfonylpiperidin-4-amine (PubChem CID 28783155) has the molecular formula C9H19N3O3S and a molecular weight of 249.34 g/mol. Its IUPAC name is 1-morpholin-4-ylsulfonylpiperidin-4-amine.

Molecular Properties

Compound Name1-morpholin-4-ylsulfonylpiperidin-4-amine
PubChem CID28783155
Molecular FormulaC9H19N3O3S
Molecular Weight249.34 g/mol
Exact Mass249.11
IUPAC Name1-morpholin-4-ylsulfonylpiperidin-4-amine
SMILESNC1CCN(S(=O)(=O)N2CCOCC2)CC1
InChIInChI=1S/C9H19N3O3S/c10-9-1-3-11(4-2-9)16(13,14)12-5-7-15-8-6-12/h9H,1-8,10H2
InChIKeyXYSKGGIRUYMGEO-UHFFFAOYSA-N
XLogP-1.01
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 5-1.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-ylsulfonylpiperidin-4-amine?
The IUPAC name of 1-morpholin-4-ylsulfonylpiperidin-4-amine (CID 28783155) is 1-morpholin-4-ylsulfonylpiperidin-4-amine.
What is the SMILES notation for 1-morpholin-4-ylsulfonylpiperidin-4-amine?
The canonical SMILES for 1-morpholin-4-ylsulfonylpiperidin-4-amine is NC1CCN(S(=O)(=O)N2CCOCC2)CC1.
What is the InChIKey of 1-morpholin-4-ylsulfonylpiperidin-4-amine?
The InChIKey is XYSKGGIRUYMGEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O3S/c10-9-1-3-11(4-2-9)16(13,14)12-5-7-15-8-6-12/h9H,1-8,10H2.
What are the key properties of 1-morpholin-4-ylsulfonylpiperidin-4-amine?
1-morpholin-4-ylsulfonylpiperidin-4-amine has a molecular weight of 249.34 g/mol, XLogP of -1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-ylsulfonylpiperidin-4-amine is sourced from PubChem (CID 28783155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).