1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine

C145H193ClF20N24O18 — CID 161484590

About 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine

1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine (PubChem CID 161484590) has the molecular formula C145H193ClF20N24O18 and a molecular weight of 2975.70 g/mol. Its IUPAC name is 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine.

Molecular Properties

• Compound Name: 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine
• PubChem CID: 161484590
• Molecular Formula: C145H193ClF20N24O18
• Molecular Weight: 2975.70 g/mol
• Exact Mass: 2973.43
• IUPAC Name: 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine
• SMILES: CC1CN(c2ccc(F)cc2F)CCN1.COCCOc1c(F)cc(N2CCNCC2)cc1F.COCCOc1cc(F)c(N2CCNCC2)c(F)c1.COCCOc1cc(F)ccc1N1CCNCC1.COCCOc1ccc(N2CCNCC2)c(F)c1.COCCOc1ccc(N2CCNCC2)cc1OC.COc1cc(F)c(N2CCNCC2)c(F)c1.COc1cc(F)c(N2CCNCC2)cc1OC.COc1cc(F)cc(F)c1N1CCNCC1.FC1(F)Cc2cc(N3CCNCC3)ccc2O1.FC1(F)Oc2ccc(N3CCNCC3)cc2OC1(F)F.Fc1cc(Cl)ccc1N1CCNCC1
• InChI: InChI=1S/C14H22N2O3.2C13H18F2N2O2.2C13H19FN2O2.C12H12F4N2O2.C12H14F2N2O.C12H17FN2O2.2C11H14F2N2O.C11H14F2N2.C10H12ClFN2/c1-17-9-10-19-13-4-3-12(11-14(13)18-2)16-7-5-15-6-8-16;1-18-6-7-19-10-8-11(14)13(12(15)9-10)17-4-2-16-3-5-17;1-18-6-7-19-13-11(14)8-10(9-12(13)15)17-4-2-16-3-5-17;1-17-8-9-18-11-2-3-13(12(14)10-11)16-6-4-15-5-7-16;1-17-8-9-18-13-10-11(14)2-3-12(13)16-6-4-15-5-7-16;13-11(14)12(15,16)20-10-7-8(1-2-9(10)19-11)18-5-3-17-4-6-18;13-12(14)8-9-7-10(1-2-11(9)17-12)16-5-3-15-4-6-16;1-16-11-7-9(13)10(8-12(11)17-2)15-5-3-14-4-6-15;1-16-8-6-9(12)11(10(13)7-8)15-4-2-14-3-5-15;1-16-10-7-8(12)6-9(13)11(10)15-4-2-14-3-5-15;1-8-7-15(5-4-14-8)11-3-2-9(12)6-10(11)13;11-8-1-2-10(9(12)7-8)14-5-3-13-4-6-14/h3-4,11,15H,5-10H2,1-2H3;2*8-9,16H,2-7H2,1H3;2*2-3,10,15H,4-9H2,1H3;1-2,7,17H,3-6H2;1-2,7,15H,3-6,8H2;7-8,14H,3-6H2,1-2H3;2*6-7,14H,2-5H2,1H3;2-3,6,8,14H,4-5,7H2,1H3;1-2,7,13H,3-6H2
• InChIKey: WEUREDMHVMTFPK-UHFFFAOYSA-N
• XLogP: 17.80
• TPSA: 349.38 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 42
• Rotatable Bonds: 37
• Heavy Atoms: 208
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2975.70
LogP ≤ 5	17.80
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	42

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine?

The IUPAC name of 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine (CID 161484590) is 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine.

What is the SMILES notation for 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine?

The canonical SMILES for 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine is CC1CN(c2ccc(F)cc2F)CCN1.COCCOc1c(F)cc(N2CCNCC2)cc1F.COCCOc1cc(F)c(N2CCNCC2)c(F)c1.COCCOc1cc(F)ccc1N1CCNCC1.COCCOc1ccc(N2CCNCC2)c(F)c1.COCCOc1ccc(N2CCNCC2)cc1OC.COc1cc(F)c(N2CCNCC2)c(F)c1.COc1cc(F)c(N2CCNCC2)cc1OC.COc1cc(F)cc(F)c1N1CCNCC1.FC1(F)Cc2cc(N3CCNCC3)ccc2O1.FC1(F)Oc2ccc(N3CCNCC3)cc2OC1(F)F.Fc1cc(Cl)ccc1N1CCNCC1.

What is the InChIKey of 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine?

The InChIKey is WEUREDMHVMTFPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3.2C13H18F2N2O2.2C13H19FN2O2.C12H12F4N2O2.C12H14F2N2O.C12H17FN2O2.2C11H14F2N2O.C11H14F2N2.C10H12ClFN2/c1-17-9-10-19-13-4-3-12(11-14(13)18-2)16-7-5-15-6-8-16;1-18-6-7-19-10-8-11(14)13(12(15)9-10)17-4-2-16-3-5-17;1-18-6-7-19-13-11(14)8-10(9-12(13)15)17-4-2-16-3-5-17;1-17-8-9-18-11-2-3-13(12(14)10-11)16-6-4-15-5-7-16;1-17-8-9-18-13-10-11(14)2-3-12(13)16-6-4-15-5-7-16;13-11(14)12(15,16)20-10-7-8(1-2-9(10)19-11)18-5-3-17-4-6-18;13-12(14)8-9-7-10(1-2-11(9)17-12)16-5-3-15-4-6-16;1-16-11-7-9(13)10(8-12(11)17-2)15-5-3-14-4-6-15;1-16-8-6-9(12)11(10(13)7-8)15-4-2-14-3-5-15;1-16-10-7-8(12)6-9(13)11(10)15-4-2-14-3-5-15;1-8-7-15(5-4-14-8)11-3-2-9(12)6-10(11)13;11-8-1-2-10(9(12)7-8)14-5-3-13-4-6-14/h3-4,11,15H,5-10H2,1-2H3;2*8-9,16H,2-7H2,1H3;2*2-3,10,15H,4-9H2,1H3;1-2,7,17H,3-6H2;1-2,7,15H,3-6,8H2;7-8,14H,3-6H2,1-2H3;2*6-7,14H,2-5H2,1H3;2-3,6,8,14H,4-5,7H2,1H3;1-2,7,13H,3-6H2.

What are the key properties of 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine?

1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine has a molecular weight of 2975.70 g/mol, XLogP of 17.80, 37 rotatable bonds, 12 hydrogen bond donors, and 42 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-chloro-2-fluorophenyl)piperazine;1-(2,2-difluoro-3H-1-benzofuran-5-yl)piperazine;1-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,4-difluoro-6-methoxyphenyl)piperazine;1-(2,6-difluoro-4-methoxyphenyl)piperazine;1-(2,4-difluorophenyl)-3-methylpiperazine;1-(2-fluoro-4,5-dimethoxyphenyl)piperazine;1-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazine;1-[4-fluoro-2-(2-methoxyethoxy)phenyl]piperazine;1-[3-methoxy-4-(2-methoxyethoxy)phenyl]piperazine;1-(2,2,3,3-tetrafluoro-1,4-benzodioxin-6-yl)piperazine is sourced from PubChem (CID 161484590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).