1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one

C11H17N3O3 — CID 43427859

IUPAC1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one
SMILESCc1noc(CCC(=O)N2CCCC(O)C2)n1
InChIInChI=1S/C11H17N3O3/c1-8-12-10(17-13-8)4-5-11(16)14-6-2-3-9(15)7-14/h9,15H,2-7H2,1H3
InChIKeyOGGJPGLZUVLQGE-UHFFFAOYSA-N
MW239.27 g/mol
LogP0.29
Rot. Bonds3

About 1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one

1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one (PubChem CID 43427859) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is 1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one.

Molecular Properties

Compound Name1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one
PubChem CID43427859
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC Name1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one
SMILESCc1noc(CCC(=O)N2CCCC(O)C2)n1
InChIInChI=1S/C11H17N3O3/c1-8-12-10(17-13-8)4-5-11(16)14-6-2-3-9(15)7-14/h9,15H,2-7H2,1H3
InChIKeyOGGJPGLZUVLQGE-UHFFFAOYSA-N
XLogP0.29
TPSA79.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one 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 1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one?
The IUPAC name of 1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one (CID 43427859) is 1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one.
What is the SMILES notation for 1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one?
The canonical SMILES for 1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one is Cc1noc(CCC(=O)N2CCCC(O)C2)n1.
What is the InChIKey of 1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one?
The InChIKey is OGGJPGLZUVLQGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-8-12-10(17-13-8)4-5-11(16)14-6-2-3-9(15)7-14/h9,15H,2-7H2,1H3.
What are the key properties of 1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one?
1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one has a molecular weight of 239.27 g/mol, XLogP of 0.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxypiperidin-1-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one is sourced from PubChem (CID 43427859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).