1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one

C108H153F3N12O17 — CID 160651217

About 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one

1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one (PubChem CID 160651217) has the molecular formula C108H153F3N12O17 and a molecular weight of 1948.47 g/mol. Its IUPAC name is 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one.

Molecular Properties

• Compound Name: 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one
• PubChem CID: 160651217
• Molecular Formula: C108H153F3N12O17
• Molecular Weight: 1948.47 g/mol
• Exact Mass: 1947.14
• IUPAC Name: 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one
• SMILES: CC(=O)N1CCN(CCCOc2ccc(C(=O)C(C)N3CCOCC3)cc2)CC1.CC(=O)N1CCN(CCCOc2ccc(C(=O)CN3CCOCC3)cc2)CC1.CC(C(=O)c1ccc(OCCCN2CCOCC2)cc1)N1CCOCC1.C[C@@H]1CCCN1CCCOc1ccc(C(=O)CN2CCC(C(F)(F)F)CC2)cc1.O=C(CN1CCOCC1)c1ccc(OCCCN2Cc3ccccc3C2)cc1
• InChI: InChI=1S/C23H28N2O3.C22H31F3N2O2.C22H33N3O4.C21H31N3O4.C20H30N2O4/c26-23(18-24-11-14-27-15-12-24)19-6-8-22(9-7-19)28-13-3-10-25-16-20-4-1-2-5-21(20)17-25;1-17-4-2-11-27(17)12-3-15-29-20-7-5-18(6-8-20)21(28)16-26-13-9-19(10-14-26)22(23,24)25;1-18(24-13-16-28-17-14-24)22(27)20-4-6-21(7-5-20)29-15-3-8-23-9-11-25(12-10-23)19(2)26;1-18(25)24-10-8-22(9-11-24)7-2-14-28-20-5-3-19(4-6-20)21(26)17-23-12-15-27-16-13-23;1-17(22-10-15-25-16-11-22)20(23)18-3-5-19(6-4-18)26-12-2-7-21-8-13-24-14-9-21/h1-2,4-9H,3,10-18H2;5-8,17,19H,2-4,9-16H2,1H3;4-7,18H,3,8-17H2,1-2H3;3-6H,2,7-17H2,1H3;3-6,17H,2,7-16H2,1H3/t;17-;;;/m.1.../s1
• InChIKey: RKLDSQADEIMIHB-DOKKIWBJSA-N
• XLogP: 11.73
• TPSA: 250.67 Ų
• H-Bond Acceptors: 27
• Rotatable Bonds: 40
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1948.47
LogP ≤ 5	11.73
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one?

The IUPAC name of 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one (CID 160651217) is 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one.

What is the SMILES notation for 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one?

The canonical SMILES for 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one is CC(=O)N1CCN(CCCOc2ccc(C(=O)C(C)N3CCOCC3)cc2)CC1.CC(=O)N1CCN(CCCOc2ccc(C(=O)CN3CCOCC3)cc2)CC1.CC(C(=O)c1ccc(OCCCN2CCOCC2)cc1)N1CCOCC1.C[C@@H]1CCCN1CCCOc1ccc(C(=O)CN2CCC(C(F)(F)F)CC2)cc1.O=C(CN1CCOCC1)c1ccc(OCCCN2Cc3ccccc3C2)cc1.

What is the InChIKey of 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one?

The InChIKey is RKLDSQADEIMIHB-DOKKIWBJSA-N. The full InChI is InChI=1S/C23H28N2O3.C22H31F3N2O2.C22H33N3O4.C21H31N3O4.C20H30N2O4/c26-23(18-24-11-14-27-15-12-24)19-6-8-22(9-7-19)28-13-3-10-25-16-20-4-1-2-5-21(20)17-25;1-17-4-2-11-27(17)12-3-15-29-20-7-5-18(6-8-20)21(28)16-26-13-9-19(10-14-26)22(23,24)25;1-18(24-13-16-28-17-14-24)22(27)20-4-6-21(7-5-20)29-15-3-8-23-9-11-25(12-10-23)19(2)26;1-18(25)24-10-8-22(9-11-24)7-2-14-28-20-5-3-19(4-6-20)21(26)17-23-12-15-27-16-13-23;1-17(22-10-15-25-16-11-22)20(23)18-3-5-19(6-4-18)26-12-2-7-21-8-13-24-14-9-21/h1-2,4-9H,3,10-18H2;5-8,17,19H,2-4,9-16H2,1H3;4-7,18H,3,8-17H2,1-2H3;3-6H,2,7-17H2,1H3;3-6,17H,2,7-16H2,1H3/t;17-;;;/m.1.../s1.

What are the key properties of 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one?

1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one has a molecular weight of 1948.47 g/mol, XLogP of 11.73, 40 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-(4-acetylpiperazin-1-yl)propoxy]phenyl]-2-morpholin-4-ylpropan-1-one;1-[4-[3-(1,3-dihydroisoindol-2-yl)propoxy]phenyl]-2-morpholin-4-ylethanone;1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-[4-(trifluoromethyl)piperidin-1-yl]ethanone;2-morpholin-4-yl-1-[4-(3-morpholin-4-ylpropoxy)phenyl]propan-1-one is sourced from PubChem (CID 160651217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).