N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid

C168H201F6N19O20 — CID 160562689

About N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid

N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid (PubChem CID 160562689) has the molecular formula C168H201F6N19O20 and a molecular weight of 2920.56 g/mol. Its IUPAC name is N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid.

Molecular Properties

• Compound Name: N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid
• PubChem CID: 160562689
• Molecular Formula: C168H201F6N19O20
• Molecular Weight: 2920.56 g/mol
• Exact Mass: 2918.52
• IUPAC Name: N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid
• SMILES: CC(=O)CCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.CCNC(=O)CCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.O=C(Cc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1)NCCN1CCCC1.O=C(Cc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1)NCCN1CCOCC1.O=C(Cc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1)NCc1ccncc1.O=C(O)C(=O)O.O=C(O)C(=O)O.O=C(O)C(=O)O.OOCCCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1
• InChI: InChI=1S/C29H37FN4O2.C29H31FN4O.C29H37FN4O.C26H32FN3O.C25H29FN2O.C24H29FN2O2.3C2H2O4/c30-26-5-2-23(3-6-26)7-12-32-13-9-27(10-14-32)34-15-8-25-4-1-24(21-28(25)34)22-29(35)31-11-16-33-17-19-36-20-18-33;30-26-5-2-22(3-6-26)9-15-33-16-11-27(12-17-33)34-18-10-25-4-1-24(19-28(25)34)20-29(35)32-21-23-7-13-31-14-8-23;30-26-7-4-23(5-8-26)9-16-33-17-11-27(12-18-33)34-19-10-25-6-3-24(21-28(25)34)22-29(35)31-13-20-32-14-1-2-15-32;1-2-28-26(31)10-6-21-3-7-22-12-18-30(25(22)19-21)24-13-16-29(17-14-24)15-11-20-4-8-23(27)9-5-20;1-19(29)2-3-21-4-7-22-11-17-28(25(22)18-21)24-12-15-27(16-13-24)14-10-20-5-8-23(26)9-6-20;25-22-7-4-19(5-8-22)9-13-26-14-11-23(12-15-26)27-16-10-21-6-3-20(18-24(21)27)2-1-17-29-28;3*3-1(4)2(5)6/h1-6,8,15,21,27H,7,9-14,16-20,22H2,(H,31,35);1-8,10,13-14,18-19,27H,9,11-12,15-17,20-21H2,(H,32,35);3-8,10,19,21,27H,1-2,9,11-18,20,22H2,(H,31,35);3-5,7-9,12,18-19,24H,2,6,10-11,13-17H2,1H3,(H,28,31);4-9,11,17-18,24H,2-3,10,12-16H2,1H3;3-8,10,16,18,23,28H,1-2,9,11-15,17H2;3*(H,3,4)(H,5,6)
• InChIKey: WZCUGWBEPJFGLX-UHFFFAOYSA-N
• XLogP: 25.44
• TPSA: 464.35 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 29
• Rotatable Bonds: 49
• Heavy Atoms: 213
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2920.56
LogP ≤ 5	25.44
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid?

The IUPAC name of N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid (CID 160562689) is N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid.

What is the SMILES notation for N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid?

The canonical SMILES for N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid is CC(=O)CCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.CCNC(=O)CCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.O=C(Cc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1)NCCN1CCCC1.O=C(Cc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1)NCCN1CCOCC1.O=C(Cc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1)NCc1ccncc1.O=C(O)C(=O)O.O=C(O)C(=O)O.O=C(O)C(=O)O.OOCCCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.

What is the InChIKey of N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid?

The InChIKey is WZCUGWBEPJFGLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H37FN4O2.C29H31FN4O.C29H37FN4O.C26H32FN3O.C25H29FN2O.C24H29FN2O2.3C2H2O4/c30-26-5-2-23(3-6-26)7-12-32-13-9-27(10-14-32)34-15-8-25-4-1-24(21-28(25)34)22-29(35)31-11-16-33-17-19-36-20-18-33;30-26-5-2-22(3-6-26)9-15-33-16-11-27(12-17-33)34-18-10-25-4-1-24(19-28(25)34)20-29(35)32-21-23-7-13-31-14-8-23;30-26-7-4-23(5-8-26)9-16-33-17-11-27(12-18-33)34-19-10-25-6-3-24(21-28(25)34)22-29(35)31-13-20-32-14-1-2-15-32;1-2-28-26(31)10-6-21-3-7-22-12-18-30(25(22)19-21)24-13-16-29(17-14-24)15-11-20-4-8-23(27)9-5-20;1-19(29)2-3-21-4-7-22-11-17-28(25(22)18-21)24-12-15-27(16-13-24)14-10-20-5-8-23(26)9-6-20;25-22-7-4-19(5-8-22)9-13-26-14-11-23(12-15-26)27-16-10-21-6-3-20(18-24(21)27)2-1-17-29-28;3*3-1(4)2(5)6/h1-6,8,15,21,27H,7,9-14,16-20,22H2,(H,31,35);1-8,10,13-14,18-19,27H,9,11-12,15-17,20-21H2,(H,32,35);3-8,10,19,21,27H,1-2,9,11-18,20,22H2,(H,31,35);3-5,7-9,12,18-19,24H,2,6,10-11,13-17H2,1H3,(H,28,31);4-9,11,17-18,24H,2-3,10,12-16H2,1H3;3-8,10,16,18,23,28H,1-2,9,11-15,17H2;3*(H,3,4)(H,5,6).

What are the key properties of N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid?

N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid has a molecular weight of 2920.56 g/mol, XLogP of 25.44, 49 rotatable bonds, 11 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for N-ethyl-3-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]propanamide;1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-6-(3-hydroperoxypropyl)indole;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]butan-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-morpholin-4-ylethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(pyridin-4-ylmethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide;oxalic acid is sourced from PubChem (CID 160562689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).