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

C14H17N3O3 — CID 56728046

IUPAC[3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone
SMILESCCc1noc(C2CCCN(C(=O)c3ccco3)C2)n1
InChIInChI=1S/C14H17N3O3/c1-2-12-15-13(20-16-12)10-5-3-7-17(9-10)14(18)11-6-4-8-19-11/h4,6,8,10H,2-3,5,7,9H2,1H3
InChIKeyGTIFVDBNNMVMRB-UHFFFAOYSA-N
MW275.31 g/mol
LogP2.24
Rot. Bonds3

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

[3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone (PubChem CID 56728046) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is [3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone.

Molecular Properties

Compound Name[3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone
PubChem CID56728046
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name[3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone
SMILESCCc1noc(C2CCCN(C(=O)c3ccco3)C2)n1
InChIInChI=1S/C14H17N3O3/c1-2-12-15-13(20-16-12)10-5-3-7-17(9-10)14(18)11-6-4-8-19-11/h4,6,8,10H,2-3,5,7,9H2,1H3
InChIKeyGTIFVDBNNMVMRB-UHFFFAOYSA-N
XLogP2.24
TPSA72.37 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-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

Related Compounds

[3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone
CID 56728060
(3S)-3-(3-ethyl-1,2,4-oxadiazol-5-yl)-N,N-dimethylpiperidine-1-carboxamide
CID 97193337
N-benzyl-4-[5-[(3R)-1-(furan-2-carbonyl)piperidin-3-yl]-1,2,4-oxadiazol-3-yl]benzenesulfonamide
CID 1457034
furan-2-yl-[(3R)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone
CID 95734780
furan-2-yl-[(3S)-3-phenylpiperidin-1-yl]methanone
CID 740547
[(3R)-3-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-1-yl]-(furan-2-yl)methanone
CID 95777767
furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone
CID 132651795
(3-chloropiperidin-1-yl)-(furan-2-yl)methanone
CID 63392823
1-[(3R)-3-[3-[(3-fluorophenyl)methyl]-1,2,4-oxadiazol-5-yl]piperidin-1-yl]ethanone
CID 100688666
furan-2-yl-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 30863498
furan-2-yl-[3-[2-methyl-5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]piperidin-1-yl]methanone
CID 16670297
furan-2-yl-(3-phenylazepan-1-yl)methanone
CID 90608497

Frequently Asked Questions

What is the IUPAC name of [3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone?
The IUPAC name of [3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone (CID 56728046) is [3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone.
What is the SMILES notation for [3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone?
The canonical SMILES for [3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone is CCc1noc(C2CCCN(C(=O)c3ccco3)C2)n1.
What is the InChIKey of [3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone?
The InChIKey is GTIFVDBNNMVMRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-2-12-15-13(20-16-12)10-5-3-7-17(9-10)14(18)11-6-4-8-19-11/h4,6,8,10H,2-3,5,7,9H2,1H3.
What are the key properties of [3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone?
[3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone has a molecular weight of 275.31 g/mol, XLogP of 2.24, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone is sourced from PubChem (CID 56728046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).