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

C19H19N3O4 — CID 53121829

IUPACfuran-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone
SMILESCOc1cccc(-c2nc(C3CCN(C(=O)c4ccoc4)CC3)no2)c1
InChIInChI=1S/C19H19N3O4/c1-24-16-4-2-3-14(11-16)18-20-17(21-26-18)13-5-8-22(9-6-13)19(23)15-7-10-25-12-15/h2-4,7,10-13H,5-6,8-9H2,1H3
InChIKeyHXPVHSRGWIXNSV-UHFFFAOYSA-N
MW353.38 g/mol
LogP3.36
Rot. Bonds4

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

furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone (PubChem CID 53121829) has the molecular formula C19H19N3O4 and a molecular weight of 353.38 g/mol. Its IUPAC name is furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone
PubChem CID53121829
Molecular FormulaC19H19N3O4
Molecular Weight353.38 g/mol
Exact Mass353.14
IUPAC Namefuran-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone
SMILESCOc1cccc(-c2nc(C3CCN(C(=O)c4ccoc4)CC3)no2)c1
InChIInChI=1S/C19H19N3O4/c1-24-16-4-2-3-14(11-16)18-20-17(21-26-18)13-5-8-22(9-6-13)19(23)15-7-10-25-12-15/h2-4,7,10-13H,5-6,8-9H2,1H3
InChIKeyHXPVHSRGWIXNSV-UHFFFAOYSA-N
XLogP3.36
TPSA81.60 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-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 furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone?
The IUPAC name of furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone (CID 53121829) is furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone.
What is the SMILES notation for furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone?
The canonical SMILES for furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone is COc1cccc(-c2nc(C3CCN(C(=O)c4ccoc4)CC3)no2)c1.
What is the InChIKey of furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone?
The InChIKey is HXPVHSRGWIXNSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4/c1-24-16-4-2-3-14(11-16)18-20-17(21-26-18)13-5-8-22(9-6-13)19(23)15-7-10-25-12-15/h2-4,7,10-13H,5-6,8-9H2,1H3.
What are the key properties of furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone?
furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone has a molecular weight of 353.38 g/mol, XLogP of 3.36, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-[4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl]methanone is sourced from PubChem (CID 53121829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).