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

C17H16N4O3 — CID 53192014

IUPACfuran-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCCCC1c1nc(-c2cccnc2)no1
InChIInChI=1S/C17H16N4O3/c22-17(14-7-4-10-23-14)21-9-2-1-6-13(21)16-19-15(20-24-16)12-5-3-8-18-11-12/h3-5,7-8,10-11,13H,1-2,6,9H2
InChIKeyOVHYTCDPXCCCAV-UHFFFAOYSA-N
MW324.34 g/mol
LogP3.09
Rot. Bonds3

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

furan-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone (PubChem CID 53192014) has the molecular formula C17H16N4O3 and a molecular weight of 324.34 g/mol. Its IUPAC name is furan-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
PubChem CID53192014
Molecular FormulaC17H16N4O3
Molecular Weight324.34 g/mol
Exact Mass324.12
IUPAC Namefuran-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCCCC1c1nc(-c2cccnc2)no1
InChIInChI=1S/C17H16N4O3/c22-17(14-7-4-10-23-14)21-9-2-1-6-13(21)16-19-15(20-24-16)12-5-3-8-18-11-12/h3-5,7-8,10-11,13H,1-2,6,9H2
InChIKeyOVHYTCDPXCCCAV-UHFFFAOYSA-N
XLogP3.09
TPSA85.26 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone?
The IUPAC name of furan-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone (CID 53192014) is furan-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone is O=C(c1ccco1)N1CCCCC1c1nc(-c2cccnc2)no1.
What is the InChIKey of furan-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone?
The InChIKey is OVHYTCDPXCCCAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3/c22-17(14-7-4-10-23-14)21-9-2-1-6-13(21)16-19-15(20-24-16)12-5-3-8-18-11-12/h3-5,7-8,10-11,13H,1-2,6,9H2.
What are the key properties of furan-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone?
furan-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone has a molecular weight of 324.34 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 53192014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).