morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone

C13H24N2O4S — CID 3236065

IUPACmorpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone
SMILESCCCS(=O)(=O)N1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C13H24N2O4S/c1-2-11-20(17,18)15-5-3-12(4-6-15)13(16)14-7-9-19-10-8-14/h12H,2-11H2,1H3
InChIKeyNUKZRFNSWOXVGX-UHFFFAOYSA-N
MW304.41 g/mol
LogP0.30
Rot. Bonds4

About morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone

morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone (PubChem CID 3236065) has the molecular formula C13H24N2O4S and a molecular weight of 304.41 g/mol. Its IUPAC name is morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone
PubChem CID3236065
Molecular FormulaC13H24N2O4S
Molecular Weight304.41 g/mol
Exact Mass304.15
IUPAC Namemorpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone
SMILESCCCS(=O)(=O)N1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C13H24N2O4S/c1-2-11-20(17,18)15-5-3-12(4-6-15)13(16)14-7-9-19-10-8-14/h12H,2-11H2,1H3
InChIKeyNUKZRFNSWOXVGX-UHFFFAOYSA-N
XLogP0.30
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.41
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone 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 morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone?
The IUPAC name of morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone (CID 3236065) is morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone.
What is the SMILES notation for morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone?
The canonical SMILES for morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone is CCCS(=O)(=O)N1CCC(C(=O)N2CCOCC2)CC1.
What is the InChIKey of morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone?
The InChIKey is NUKZRFNSWOXVGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O4S/c1-2-11-20(17,18)15-5-3-12(4-6-15)13(16)14-7-9-19-10-8-14/h12H,2-11H2,1H3.
What are the key properties of morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone?
morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone has a molecular weight of 304.41 g/mol, XLogP of 0.30, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-(1-propylsulfonylpiperidin-4-yl)methanone is sourced from PubChem (CID 3236065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).