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

C19H19N3O3 — CID 132651795

IUPACfuran-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone
SMILESCc1ccc(-c2nnc(C3CCCN(C(=O)c4ccco4)C3)o2)cc1
InChIInChI=1S/C19H19N3O3/c1-13-6-8-14(9-7-13)17-20-21-18(25-17)15-4-2-10-22(12-15)19(23)16-5-3-11-24-16/h3,5-9,11,15H,2,4,10,12H2,1H3
InChIKeyYHBLGQYIAGAHTN-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.66
Rot. Bonds3

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

furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone (PubChem CID 132651795) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone
PubChem CID132651795
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Namefuran-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone
SMILESCc1ccc(-c2nnc(C3CCCN(C(=O)c4ccco4)C3)o2)cc1
InChIInChI=1S/C19H19N3O3/c1-13-6-8-14(9-7-13)17-20-21-18(25-17)15-4-2-10-22(12-15)19(23)16-5-3-11-24-16/h3,5-9,11,15H,2,4,10,12H2,1H3
InChIKeyYHBLGQYIAGAHTN-UHFFFAOYSA-N
XLogP3.66
TPSA72.37 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]-(furan-2-yl)methanone
CID 132652159
1-[(3S)-3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]ethanone
CID 99963730
furan-2-yl-[(3R)-3-[5-(4-methylpyrimidin-5-yl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone
CID 99964034
furan-2-yl-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 30863498
[3-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]-(4-methylphenyl)methanone
CID 121069334
(4-fluorophenyl)-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone
CID 132654703
phenyl-[(3S)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 92897703
furan-3-yl-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 46392997
1-[3-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]-2-(3-methylphenyl)ethanone
CID 121069413
(3-chloro-2-methylphenyl)-[(3S)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 71654170
[3-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-2-yl)methanone
CID 56728046
furan-2-yl-[(3S)-3-phenylpiperidin-1-yl]methanone
CID 740547

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone?
The IUPAC name of furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone (CID 132651795) is furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone is Cc1ccc(-c2nnc(C3CCCN(C(=O)c4ccco4)C3)o2)cc1.
What is the InChIKey of furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone?
The InChIKey is YHBLGQYIAGAHTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-13-6-8-14(9-7-13)17-20-21-18(25-17)15-4-2-10-22(12-15)19(23)16-5-3-11-24-16/h3,5-9,11,15H,2,4,10,12H2,1H3.
What are the key properties of furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone?
furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone has a molecular weight of 337.38 g/mol, XLogP of 3.66, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone is sourced from PubChem (CID 132651795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).