N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide

C122H144Cl4F9IN24O6 — CID 158570323

About N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide

N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide (PubChem CID 158570323) has the molecular formula C122H144Cl4F9IN24O6 and a molecular weight of 2482.35 g/mol. Its IUPAC name is N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide.

Molecular Properties

• Compound Name: N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide
• PubChem CID: 158570323
• Molecular Formula: C122H144Cl4F9IN24O6
• Molecular Weight: 2482.35 g/mol
• Exact Mass: 2478.94
• IUPAC Name: N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide
• SMILES: CC(C)C1CN(c2ncccc2Cl)CCN1C(=O)Nc1ccc(C(C)(C)C)cc1.CC(C)c1ccc(NC(=O)N2C(C)CN(c3ncccc3Cl)CC2C)cc1.CC1CN(c2ncccc2Cl)CC(C)N1C(=O)Nc1ccc(C(F)(F)F)cc1.CC1CN(c2ncccc2Cl)CC(C)N1C(=O)Nc1ccc(C2CCCCC2)cc1.C[C@@H]1CN(c2ncccc2F)CCN1C(=O)Nc1ccc(C(F)(F)F)c(F)c1.C[C@@H]1CN(c2ncccc2F)CCN1C(=O)Nc1cccc(I)c1
• InChI: InChI=1S/C24H31ClN4O.C23H31ClN4O.C21H27ClN4O.C19H20ClF3N4O.C18H17F5N4O.C17H18FIN4O/c1-17-15-28(23-22(25)9-6-14-26-23)16-18(2)29(17)24(30)27-21-12-10-20(11-13-21)19-7-4-3-5-8-19;1-16(2)20-15-27(21-19(24)7-6-12-25-21)13-14-28(20)22(29)26-18-10-8-17(9-11-18)23(3,4)5;1-14(2)17-7-9-18(10-8-17)24-21(27)26-15(3)12-25(13-16(26)4)20-19(22)6-5-11-23-20;1-12-10-26(17-16(20)4-3-9-24-17)11-13(2)27(12)18(28)25-15-7-5-14(6-8-15)19(21,22)23;1-11-10-26(16-14(19)3-2-6-24-16)7-8-27(11)17(28)25-12-4-5-13(15(20)9-12)18(21,22)23;1-12-11-22(16-15(18)6-3-7-20-16)8-9-23(12)17(24)21-14-5-2-4-13(19)10-14/h6,9-14,17-19H,3-5,7-8,15-16H2,1-2H3,(H,27,30);6-12,16,20H,13-15H2,1-5H3,(H,26,29);5-11,14-16H,12-13H2,1-4H3,(H,24,27);3-9,12-13H,10-11H2,1-2H3,(H,25,28);2-6,9,11H,7-8,10H2,1H3,(H,25,28);2-7,10,12H,8-9,11H2,1H3,(H,21,24)/t;;;;11-;12-/m....11/s1
• InChIKey: HRZOLPDBIFLXOX-FIDOLORISA-N
• XLogP: 28.89
• TPSA: 290.82 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 18
• Rotatable Bonds: 15
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2482.35
LogP ≤ 5	28.89
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide?

The IUPAC name of N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide (CID 158570323) is N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide.

What is the SMILES notation for N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide?

The canonical SMILES for N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide is CC(C)C1CN(c2ncccc2Cl)CCN1C(=O)Nc1ccc(C(C)(C)C)cc1.CC(C)c1ccc(NC(=O)N2C(C)CN(c3ncccc3Cl)CC2C)cc1.CC1CN(c2ncccc2Cl)CC(C)N1C(=O)Nc1ccc(C(F)(F)F)cc1.CC1CN(c2ncccc2Cl)CC(C)N1C(=O)Nc1ccc(C2CCCCC2)cc1.C[C@@H]1CN(c2ncccc2F)CCN1C(=O)Nc1ccc(C(F)(F)F)c(F)c1.C[C@@H]1CN(c2ncccc2F)CCN1C(=O)Nc1cccc(I)c1.

What is the InChIKey of N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide?

The InChIKey is HRZOLPDBIFLXOX-FIDOLORISA-N. The full InChI is InChI=1S/C24H31ClN4O.C23H31ClN4O.C21H27ClN4O.C19H20ClF3N4O.C18H17F5N4O.C17H18FIN4O/c1-17-15-28(23-22(25)9-6-14-26-23)16-18(2)29(17)24(30)27-21-12-10-20(11-13-21)19-7-4-3-5-8-19;1-16(2)20-15-27(21-19(24)7-6-12-25-21)13-14-28(20)22(29)26-18-10-8-17(9-11-18)23(3,4)5;1-14(2)17-7-9-18(10-8-17)24-21(27)26-15(3)12-25(13-16(26)4)20-19(22)6-5-11-23-20;1-12-10-26(17-16(20)4-3-9-24-17)11-13(2)27(12)18(28)25-15-7-5-14(6-8-15)19(21,22)23;1-11-10-26(16-14(19)3-2-6-24-16)7-8-27(11)17(28)25-12-4-5-13(15(20)9-12)18(21,22)23;1-12-11-22(16-15(18)6-3-7-20-16)8-9-23(12)17(24)21-14-5-2-4-13(19)10-14/h6,9-14,17-19H,3-5,7-8,15-16H2,1-2H3,(H,27,30);6-12,16,20H,13-15H2,1-5H3,(H,26,29);5-11,14-16H,12-13H2,1-4H3,(H,24,27);3-9,12-13H,10-11H2,1-2H3,(H,25,28);2-6,9,11H,7-8,10H2,1H3,(H,25,28);2-7,10,12H,8-9,11H2,1H3,(H,21,24)/t;;;;11-;12-/m....11/s1.

What are the key properties of N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide?

N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide has a molecular weight of 2482.35 g/mol, XLogP of 28.89, 15 rotatable bonds, 6 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide is sourced from PubChem (CID 158570323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).