N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole

C143H172FN31O15 — CID 158864140

About N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole

N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole (PubChem CID 158864140) has the molecular formula C143H172FN31O15 and a molecular weight of 2584.15 g/mol. Its IUPAC name is N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole.

Molecular Properties

• Compound Name: N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole
• PubChem CID: 158864140
• Molecular Formula: C143H172FN31O15
• Molecular Weight: 2584.15 g/mol
• Exact Mass: 2582.36
• IUPAC Name: N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole
• SMILES: C=CCN(C(=O)CCc1ccc([N+](=O)[O-])cc1)C1C[C@H]2CC[C@@H](C1)N2.COc1ccc(Cc2noc(C3CCNCC3)n2)cc1.Fc1ccc(Cc2noc(C3CCNCC3)n2)cc1.O=[N+]([O-])c1ccc(Cc2noc(C3CCNCC3)n2)cc1.c1ccc(-c2cnc(C3CCNCC3)o2)cc1.c1ccc(-c2nnc(C3CCNCC3)o2)cc1.c1ccc(-c2noc(C3CCNCC3)n2)cc1.c1ccc(Cc2nnc(C3CCNCC3)o2)cc1.c1ccc(Cc2noc(C3CCNCC3)n2)cc1.c1cncc(Cc2noc(C3CCNCC3)n2)c1
• InChI: InChI=1S/C19H25N3O3.C15H19N3O2.C14H16FN3O.C14H16N4O3.2C14H17N3O.C14H16N2O.C13H16N4O.2C13H15N3O/c1-2-11-21(18-12-15-6-7-16(13-18)20-15)19(23)10-5-14-3-8-17(9-4-14)22(24)25;1-19-13-4-2-11(3-5-13)10-14-17-15(20-18-14)12-6-8-16-9-7-12;15-12-3-1-10(2-4-12)9-13-17-14(19-18-13)11-5-7-16-8-6-11;19-18(20)12-3-1-10(2-4-12)9-13-16-14(21-17-13)11-5-7-15-8-6-11;1-2-4-11(5-3-1)10-13-16-17-14(18-13)12-6-8-15-9-7-12;1-2-4-11(5-3-1)10-13-16-14(18-17-13)12-6-8-15-9-7-12;1-2-4-11(5-3-1)13-10-16-14(17-13)12-6-8-15-9-7-12;1-2-10(9-15-5-1)8-12-16-13(18-17-12)11-3-6-14-7-4-11;1-2-4-10(5-3-1)12-15-16-13(17-12)11-6-8-14-9-7-11;1-2-4-10(5-3-1)12-15-13(17-16-12)11-6-8-14-9-7-11/h2-4,8-9,15-16,18,20H,1,5-7,10-13H2;2-5,12,16H,6-10H2,1H3;1-4,11,16H,5-9H2;1-4,11,15H,5-9H2;2*1-5,12,15H,6-10H2;1-5,10,12,15H,6-9H2;1-2,5,9,11,14H,3-4,6-8H2;2*1-5,11,14H,6-9H2/t15-,16+,18?
• InChIKey: JBAAYVYOHULCEL-POFCWKIRSA-N
• XLogP: 22.26
• TPSA: 586.40 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 43
• Rotatable Bonds: 33
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2584.15
LogP ≤ 5	22.26
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	43

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole?

The IUPAC name of N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole (CID 158864140) is N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole.

What is the SMILES notation for N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole?

The canonical SMILES for N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole is C=CCN(C(=O)CCc1ccc([N+](=O)[O-])cc1)C1C[C@H]2CC[C@@H](C1)N2.COc1ccc(Cc2noc(C3CCNCC3)n2)cc1.Fc1ccc(Cc2noc(C3CCNCC3)n2)cc1.O=[N+]([O-])c1ccc(Cc2noc(C3CCNCC3)n2)cc1.c1ccc(-c2cnc(C3CCNCC3)o2)cc1.c1ccc(-c2nnc(C3CCNCC3)o2)cc1.c1ccc(-c2noc(C3CCNCC3)n2)cc1.c1ccc(Cc2nnc(C3CCNCC3)o2)cc1.c1ccc(Cc2noc(C3CCNCC3)n2)cc1.c1cncc(Cc2noc(C3CCNCC3)n2)c1.

What is the InChIKey of N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole?

The InChIKey is JBAAYVYOHULCEL-POFCWKIRSA-N. The full InChI is InChI=1S/C19H25N3O3.C15H19N3O2.C14H16FN3O.C14H16N4O3.2C14H17N3O.C14H16N2O.C13H16N4O.2C13H15N3O/c1-2-11-21(18-12-15-6-7-16(13-18)20-15)19(23)10-5-14-3-8-17(9-4-14)22(24)25;1-19-13-4-2-11(3-5-13)10-14-17-15(20-18-14)12-6-8-16-9-7-12;15-12-3-1-10(2-4-12)9-13-17-14(19-18-13)11-5-7-16-8-6-11;19-18(20)12-3-1-10(2-4-12)9-13-16-14(21-17-13)11-5-7-15-8-6-11;1-2-4-11(5-3-1)10-13-16-17-14(18-13)12-6-8-15-9-7-12;1-2-4-11(5-3-1)10-13-16-14(18-17-13)12-6-8-15-9-7-12;1-2-4-11(5-3-1)13-10-16-14(17-13)12-6-8-15-9-7-12;1-2-10(9-15-5-1)8-12-16-13(18-17-12)11-3-6-14-7-4-11;1-2-4-10(5-3-1)12-15-16-13(17-12)11-6-8-14-9-7-11;1-2-4-10(5-3-1)12-15-13(17-16-12)11-6-8-14-9-7-11/h2-4,8-9,15-16,18,20H,1,5-7,10-13H2;2-5,12,16H,6-10H2,1H3;1-4,11,16H,5-9H2;1-4,11,15H,5-9H2;2*1-5,12,15H,6-10H2;1-5,10,12,15H,6-9H2;1-2,5,9,11,14H,3-4,6-8H2;2*1-5,11,14H,6-9H2/t15-,16+,18?;;;;;;;;;.

What are the key properties of N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole?

N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole has a molecular weight of 2584.15 g/mol, XLogP of 22.26, 33 rotatable bonds, 10 hydrogen bond donors, and 43 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-3-(4-nitrophenyl)-N-prop-2-enylpropanamide;2-benzyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-benzyl-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-methoxyphenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;3-[(4-nitrophenyl)methyl]-5-piperidin-4-yl-1,2,4-oxadiazole;2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;3-phenyl-5-piperidin-4-yl-1,2,4-oxadiazole;5-phenyl-2-piperidin-4-yl-1,3-oxazole;5-piperidin-4-yl-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole is sourced from PubChem (CID 158864140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).