2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole

C14H22N2O3S — CID 126835098

IUPAC2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole
SMILESO=S(=O)(C1CCCCC1)N1CCC(c2ncco2)CC1
InChIInChI=1S/C14H22N2O3S/c17-20(18,13-4-2-1-3-5-13)16-9-6-12(7-10-16)14-15-8-11-19-14/h8,11-13H,1-7,9-10H2
InChIKeyHGUSIWPHGOQVSL-UHFFFAOYSA-N
MW298.41 g/mol
LogP2.52
Rot. Bonds3

About 2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole

2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole (PubChem CID 126835098) has the molecular formula C14H22N2O3S and a molecular weight of 298.41 g/mol. Its IUPAC name is 2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole.

Molecular Properties

Compound Name2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole
PubChem CID126835098
Molecular FormulaC14H22N2O3S
Molecular Weight298.41 g/mol
Exact Mass298.14
IUPAC Name2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole
SMILESO=S(=O)(C1CCCCC1)N1CCC(c2ncco2)CC1
InChIInChI=1S/C14H22N2O3S/c17-20(18,13-4-2-1-3-5-13)16-9-6-12(7-10-16)14-15-8-11-19-14/h8,11-13H,1-7,9-10H2
InChIKeyHGUSIWPHGOQVSL-UHFFFAOYSA-N
XLogP2.52
TPSA63.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole 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-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole?
The IUPAC name of 2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole (CID 126835098) is 2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole.
What is the SMILES notation for 2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole?
The canonical SMILES for 2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole is O=S(=O)(C1CCCCC1)N1CCC(c2ncco2)CC1.
What is the InChIKey of 2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole?
The InChIKey is HGUSIWPHGOQVSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3S/c17-20(18,13-4-2-1-3-5-13)16-9-6-12(7-10-16)14-15-8-11-19-14/h8,11-13H,1-7,9-10H2.
What are the key properties of 2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole?
2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole has a molecular weight of 298.41 g/mol, XLogP of 2.52, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexylsulfonylpiperidin-4-yl)-1,3-oxazole is sourced from PubChem (CID 126835098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).