[2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone

C15H19N3O3 — CID 56728276

IUPAC[2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone
SMILESCCc1noc(C2CCCCN2C(=O)c2ccc(C)o2)n1
InChIInChI=1S/C15H19N3O3/c1-3-13-16-14(21-17-13)11-6-4-5-9-18(11)15(19)12-8-7-10(2)20-12/h7-8,11H,3-6,9H2,1-2H3
InChIKeyBZZQNCKGCUAFGA-UHFFFAOYSA-N
MW289.33 g/mol
LogP2.90
Rot. Bonds3

About [2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone

[2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone (PubChem CID 56728276) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is [2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone.

Molecular Properties

Compound Name[2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone
PubChem CID56728276
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name[2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone
SMILESCCc1noc(C2CCCCN2C(=O)c2ccc(C)o2)n1
InChIInChI=1S/C15H19N3O3/c1-3-13-16-14(21-17-13)11-6-4-5-9-18(11)15(19)12-8-7-10(2)20-12/h7-8,11H,3-6,9H2,1-2H3
InChIKeyBZZQNCKGCUAFGA-UHFFFAOYSA-N
XLogP2.90
TPSA72.37 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone?
The IUPAC name of [2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone (CID 56728276) is [2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone.
What is the SMILES notation for [2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone?
The canonical SMILES for [2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone is CCc1noc(C2CCCCN2C(=O)c2ccc(C)o2)n1.
What is the InChIKey of [2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone?
The InChIKey is BZZQNCKGCUAFGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-3-13-16-14(21-17-13)11-6-4-5-9-18(11)15(19)12-8-7-10(2)20-12/h7-8,11H,3-6,9H2,1-2H3.
What are the key properties of [2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone?
[2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone has a molecular weight of 289.33 g/mol, XLogP of 2.90, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone is sourced from PubChem (CID 56728276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).