5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole

C19H19N3O — CID 59657751

IUPAC5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole
SMILESc1ccc(-c2ccc(-c3nc(C4CCNCC4)no3)cc2)cc1
InChIInChI=1S/C19H19N3O/c1-2-4-14(5-3-1)15-6-8-17(9-7-15)19-21-18(22-23-19)16-10-12-20-13-11-16/h1-9,16,20H,10-13H2
InChIKeyFFSPWZUQUJUZAQ-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.87
Rot. Bonds3

About 5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole

5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole (PubChem CID 59657751) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole
PubChem CID59657751
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole
SMILESc1ccc(-c2ccc(-c3nc(C4CCNCC4)no3)cc2)cc1
InChIInChI=1S/C19H19N3O/c1-2-4-14(5-3-1)15-6-8-17(9-7-15)19-21-18(22-23-19)16-10-12-20-13-11-16/h1-9,16,20H,10-13H2
InChIKeyFFSPWZUQUJUZAQ-UHFFFAOYSA-N
XLogP3.87
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole 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

5-phenyl-3-[(3R)-pyrrolidin-3-yl]-1,2,4-oxadiazole
CID 99727838
5-(4-fluorophenyl)-3-piperidin-4-yl-1,2,4-oxadiazole;hydrochloride
CID 139035121
5-(4-methoxyphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole
CID 63015385
5-phenyl-3-[(3R)-piperidin-3-yl]-1,2,4-oxadiazole
CID 86326580
5-(4-fluorophenyl)-3-pyrrolidin-3-yl-1,2,4-oxadiazole
CID 84696560
5-(2,6-difluorophenyl)-3-piperidin-4-yl-1,2,4-oxadiazole
CID 63014868
3-cyclopropyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-1,2,4-oxadiazole
CID 75527923
5-(3-chlorophenyl)-3-[(3S)-pyrrolidin-3-yl]-1,2,4-oxadiazole
CID 129462471
3-phenyl-5-piperidin-4-yl-1,2-oxazole
CID 59732015
3-(azetidin-3-yl)-5-(4-methylphenyl)-1,2,4-oxadiazole
CID 84681088
5-(4-phenylphenyl)-3-(1-propan-2-ylpiperidin-3-yl)-1,2,4-oxadiazole
CID 59657771
5-(4-methylphenyl)-3-[(3S)-piperidin-3-yl]-1,2,4-oxadiazole
CID 94939484

Frequently Asked Questions

What is the IUPAC name of 5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole?
The IUPAC name of 5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole (CID 59657751) is 5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole.
What is the SMILES notation for 5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole?
The canonical SMILES for 5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole is c1ccc(-c2ccc(-c3nc(C4CCNCC4)no3)cc2)cc1.
What is the InChIKey of 5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole?
The InChIKey is FFSPWZUQUJUZAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-2-4-14(5-3-1)15-6-8-17(9-7-15)19-21-18(22-23-19)16-10-12-20-13-11-16/h1-9,16,20H,10-13H2.
What are the key properties of 5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole?
5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole has a molecular weight of 305.38 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-phenylphenyl)-3-piperidin-4-yl-1,2,4-oxadiazole is sourced from PubChem (CID 59657751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).