1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine

C128H177BrCl3F8N27O5 — CID 162029051

About 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine

1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine (PubChem CID 162029051) has the molecular formula C128H177BrCl3F8N27O5 and a molecular weight of 2512.25 g/mol. Its IUPAC name is 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine.

Molecular Properties

• Compound Name: 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine
• PubChem CID: 162029051
• Molecular Formula: C128H177BrCl3F8N27O5
• Molecular Weight: 2512.25 g/mol
• Exact Mass: 2508.25
• IUPAC Name: 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine
• SMILES: C1=CN2CCCCCN2C1.CC(F)(F)c1ccc(N2CCNCC2)nc1.COc1cc(N2CCNCC2)ccc1Br.COc1ccc(N2CCNCC2)c(OC)c1.Cc1ccc(N2CCNCC2)c(C)c1.Cc1ccc(N2CCNCC2)cc1.Cc1ccc(N2CCNCC2)cc1C.Clc1ccc(N2CCNCC2)cc1Cl.FC(F)(F)c1cc(N2CCNCC2)ccc1Cl.FC(F)(F)c1cccc(N2CCNCC2)c1.c1cc2c(cc1N1CCNCC1)OCO2.c1cnc(N2CCNCC2)nc1
• InChI: InChI=1S/C12H18N2O2.2C12H18N2.C11H15BrN2O.C11H12ClF3N2.C11H13F3N2.C11H15F2N3.C11H14N2O2.C11H16N2.C10H12Cl2N2.C8H12N4.C8H14N2/c1-15-10-3-4-11(12(9-10)16-2)14-7-5-13-6-8-14;1-10-3-4-12(9-11(10)2)14-7-5-13-6-8-14;1-10-3-4-12(11(2)9-10)14-7-5-13-6-8-14;1-15-11-8-9(2-3-10(11)12)14-6-4-13-5-7-14;12-10-2-1-8(7-9(10)11(13,14)15)17-5-3-16-4-6-17;12-11(13,14)9-2-1-3-10(8-9)16-6-4-15-5-7-16;1-11(12,13)9-2-3-10(15-8-9)16-6-4-14-5-7-16;1-2-10-11(15-8-14-10)7-9(1)13-5-3-12-4-6-13;1-10-2-4-11(5-3-10)13-8-6-12-7-9-13;11-9-2-1-8(7-10(9)12)14-5-3-13-4-6-14;1-2-10-8(11-3-1)12-6-4-9-5-7-12;1-2-5-9-7-4-8-10(9)6-3-1/h3-4,9,13H,5-8H2,1-2H3;2*3-4,9,13H,5-8H2,1-2H3;2-3,8,13H,4-7H2,1H3;1-2,7,16H,3-6H2;1-3,8,15H,4-7H2;2-3,8,14H,4-7H2,1H3;1-2,7,12H,3-6,8H2;2-5,12H,6-9H2,1H3;1-2,7,13H,3-6H2;1-3,9H,4-7H2;4,7H,1-3,5-6,8H2
• InChIKey: YVTVNZMJZTWUPT-UHFFFAOYSA-N
• XLogP: 18.63
• TPSA: 259.27 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 32
• Rotatable Bonds: 15
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2512.25
LogP ≤ 5	18.63
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine?

The IUPAC name of 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine (CID 162029051) is 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine.

What is the SMILES notation for 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine?

The canonical SMILES for 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine is C1=CN2CCCCCN2C1.CC(F)(F)c1ccc(N2CCNCC2)nc1.COc1cc(N2CCNCC2)ccc1Br.COc1ccc(N2CCNCC2)c(OC)c1.Cc1ccc(N2CCNCC2)c(C)c1.Cc1ccc(N2CCNCC2)cc1.Cc1ccc(N2CCNCC2)cc1C.Clc1ccc(N2CCNCC2)cc1Cl.FC(F)(F)c1cc(N2CCNCC2)ccc1Cl.FC(F)(F)c1cccc(N2CCNCC2)c1.c1cc2c(cc1N1CCNCC1)OCO2.c1cnc(N2CCNCC2)nc1.

What is the InChIKey of 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine?

The InChIKey is YVTVNZMJZTWUPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2.2C12H18N2.C11H15BrN2O.C11H12ClF3N2.C11H13F3N2.C11H15F2N3.C11H14N2O2.C11H16N2.C10H12Cl2N2.C8H12N4.C8H14N2/c1-15-10-3-4-11(12(9-10)16-2)14-7-5-13-6-8-14;1-10-3-4-12(9-11(10)2)14-7-5-13-6-8-14;1-10-3-4-12(11(2)9-10)14-7-5-13-6-8-14;1-15-11-8-9(2-3-10(11)12)14-6-4-13-5-7-14;12-10-2-1-8(7-9(10)11(13,14)15)17-5-3-16-4-6-17;12-11(13,14)9-2-1-3-10(8-9)16-6-4-15-5-7-16;1-11(12,13)9-2-3-10(15-8-9)16-6-4-14-5-7-16;1-2-10-11(15-8-14-10)7-9(1)13-5-3-12-4-6-13;1-10-2-4-11(5-3-10)13-8-6-12-7-9-13;11-9-2-1-8(7-10(9)12)14-5-3-13-4-6-14;1-2-10-8(11-3-1)12-6-4-9-5-7-12;1-2-5-9-7-4-8-10(9)6-3-1/h3-4,9,13H,5-8H2,1-2H3;2*3-4,9,13H,5-8H2,1-2H3;2-3,8,13H,4-7H2,1H3;1-2,7,16H,3-6H2;1-3,8,15H,4-7H2;2-3,8,14H,4-7H2,1H3;1-2,7,12H,3-6,8H2;2-5,12H,6-9H2,1H3;1-2,7,13H,3-6H2;1-3,9H,4-7H2;4,7H,1-3,5-6,8H2.

What are the key properties of 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine?

1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine has a molecular weight of 2512.25 g/mol, XLogP of 18.63, 15 rotatable bonds, 11 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(1,3-benzodioxol-5-yl)piperazine;1-(4-bromo-3-methoxyphenyl)piperazine;1-[4-chloro-3-(trifluoromethyl)phenyl]piperazine;1-(3,4-dichlorophenyl)piperazine;1-[5-(1,1-difluoroethyl)-2-pyridinyl]piperazine;1-(2,4-dimethoxyphenyl)piperazine;1-(2,4-dimethylphenyl)piperazine;1-(3,4-dimethylphenyl)piperazine;1,5,6,7,8,9-hexahydropyrazolo[1,2-a]diazepine;1-(4-methylphenyl)piperazine;2-piperazin-1-ylpyrimidine;1-[3-(trifluoromethyl)phenyl]piperazine is sourced from PubChem (CID 162029051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).