N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine

C166H196N22O6 — CID 160792186

About N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine

N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine (PubChem CID 160792186) has the molecular formula C166H196N22O6 and a molecular weight of 2595.54 g/mol. Its IUPAC name is N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine.

Molecular Properties

• Compound Name: N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine
• PubChem CID: 160792186
• Molecular Formula: C166H196N22O6
• Molecular Weight: 2595.54 g/mol
• Exact Mass: 2593.57
• IUPAC Name: N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine
• SMILES: CCCC/C(=C\c1nnc(-c2ccc(CNCCC)c3ncccc23)o1)c1ccccc1.CCCCC(Cc1nnc(-c2ccc(CNCCC)c3ncccc23)o1)c1ccccc1.CCCCCC(Cc1nnc(-c2ccc(CNCCC)c3ccccc23)o1)c1ccccc1.CCCCCC(Cc1nnc(-c2ccc(CNCCCC)c3ccccc23)o1)c1ccccc1.CCCCNCc1ccc(-c2nnc(CC(CCC)c3ccccc3)o2)c2cccnc12.CCCNCc1ccc(-c2nnc(CC(CCC)c3ccccc3)o2)c2cccnc12
• InChI: InChI=1S/C30H37N3O.C29H35N3O.C27H32N4O.C27H30N4O.C27H32N4O.C26H30N4O/c1-3-5-8-15-24(23-13-9-7-10-14-23)21-29-32-33-30(34-29)28-19-18-25(22-31-20-6-4-2)26-16-11-12-17-27(26)28;1-3-5-7-14-23(22-12-8-6-9-13-22)20-28-31-32-29(33-28)27-18-17-24(21-30-19-4-2)25-15-10-11-16-26(25)27;2*1-3-5-10-21(20-11-7-6-8-12-20)18-25-30-31-27(32-25)24-15-14-22(19-28-16-4-2)26-23(24)13-9-17-29-26;1-3-5-16-28-19-22-14-15-24(23-13-9-17-29-26(22)23)27-31-30-25(32-27)18-21(10-4-2)20-11-7-6-8-12-20;1-3-9-20(19-10-6-5-7-11-19)17-24-29-30-26(31-24)23-14-13-21(18-27-15-4-2)25-22(23)12-8-16-28-25/h7,9-14,16-19,24,31H,3-6,8,15,20-22H2,1-2H3;6,8-13,15-18,23,30H,3-5,7,14,19-21H2,1-2H3;6-9,11-15,17,21,28H,3-5,10,16,18-19H2,1-2H3;6-9,11-15,17-18,28H,3-5,10,16,19H2,1-2H3;6-9,11-15,17,21,28H,3-5,10,16,18-19H2,1-2H3;5-8,10-14,16,20,27H,3-4,9,15,17-18H2,1-2H3/b;;;21-18+
• InChIKey: SBYYJWMJLIADCT-SOEKANIVSA-N
• XLogP: 40.01
• TPSA: 357.26 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 28
• Rotatable Bonds: 67
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2595.54
LogP ≤ 5	40.01
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine?

The IUPAC name of N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine (CID 160792186) is N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine.

What is the SMILES notation for N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine?

The canonical SMILES for N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine is CCCC/C(=C\c1nnc(-c2ccc(CNCCC)c3ncccc23)o1)c1ccccc1.CCCCC(Cc1nnc(-c2ccc(CNCCC)c3ncccc23)o1)c1ccccc1.CCCCCC(Cc1nnc(-c2ccc(CNCCC)c3ccccc23)o1)c1ccccc1.CCCCCC(Cc1nnc(-c2ccc(CNCCCC)c3ccccc23)o1)c1ccccc1.CCCCNCc1ccc(-c2nnc(CC(CCC)c3ccccc3)o2)c2cccnc12.CCCNCc1ccc(-c2nnc(CC(CCC)c3ccccc3)o2)c2cccnc12.

What is the InChIKey of N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine?

The InChIKey is SBYYJWMJLIADCT-SOEKANIVSA-N. The full InChI is InChI=1S/C30H37N3O.C29H35N3O.C27H32N4O.C27H30N4O.C27H32N4O.C26H30N4O/c1-3-5-8-15-24(23-13-9-7-10-14-23)21-29-32-33-30(34-29)28-19-18-25(22-31-20-6-4-2)26-16-11-12-17-27(26)28;1-3-5-7-14-23(22-12-8-6-9-13-22)20-28-31-32-29(33-28)27-18-17-24(21-30-19-4-2)25-15-10-11-16-26(25)27;2*1-3-5-10-21(20-11-7-6-8-12-20)18-25-30-31-27(32-25)24-15-14-22(19-28-16-4-2)26-23(24)13-9-17-29-26;1-3-5-16-28-19-22-14-15-24(23-13-9-17-29-26(22)23)27-31-30-25(32-27)18-21(10-4-2)20-11-7-6-8-12-20;1-3-9-20(19-10-6-5-7-11-19)17-24-29-30-26(31-24)23-14-13-21(18-27-15-4-2)25-22(23)12-8-16-28-25/h7,9-14,16-19,24,31H,3-6,8,15,20-22H2,1-2H3;6,8-13,15-18,23,30H,3-5,7,14,19-21H2,1-2H3;6-9,11-15,17,21,28H,3-5,10,16,18-19H2,1-2H3;6-9,11-15,17-18,28H,3-5,10,16,19H2,1-2H3;6-9,11-15,17,21,28H,3-5,10,16,18-19H2,1-2H3;5-8,10-14,16,20,27H,3-4,9,15,17-18H2,1-2H3/b;;;21-18+;;.

What are the key properties of N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine?

N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine has a molecular weight of 2595.54 g/mol, XLogP of 40.01, 67 rotatable bonds, 6 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]butan-1-amine;N-[[4-[5-(2-phenylheptyl)-1,3,4-oxadiazol-2-yl]naphthalen-1-yl]methyl]propan-1-amine;N-[[5-[5-[(E)-2-phenylhex-1-enyl]-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylhexyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]butan-1-amine;N-[[5-[5-(2-phenylpentyl)-1,3,4-oxadiazol-2-yl]quinolin-8-yl]methyl]propan-1-amine is sourced from PubChem (CID 160792186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).