4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride

C141H228Cl10F8N26O33S6 — CID 158058952

About 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride

4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride (PubChem CID 158058952) has the molecular formula C141H228Cl10F8N26O33S6 and a molecular weight of 3514.44 g/mol. Its IUPAC name is 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride.

Molecular Properties

• Compound Name: 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride
• PubChem CID: 158058952
• Molecular Formula: C141H228Cl10F8N26O33S6
• Molecular Weight: 3514.44 g/mol
• Exact Mass: 3507.20
• IUPAC Name: 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride
• SMILES: C.CCCCCc1ccc(N2CCN(S(=O)(=O)C3(C(=O)NO)CCN(CC)CC3)CC2)cc1F.CCCCCc1ccc(N2CCN(S(=O)(=O)C3(C(=O)NO)CCN(CCOC)CC3)CC2)cc1.CCCCCc1ccc(N2CCN(S(=O)(=O)C3(C(=O)NO)CCN(CCOC)CC3)CC2)cc1F.CCCCOc1ccc(N2CCN(S(=O)(=O)C3(C(=O)NO)CCN(C(=O)N4CCNC(=O)C4=O)CC3)CC2)cc1.COCCN1CCC(C(=O)NO)(S(=O)(=O)N2CCN(c3ccc(OC(F)(F)C(F)(F)F)cc3)CC2)CC1.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.O=C(NO)C1(S(=O)(=O)N2CCN(c3ccc(OCC4CC4)c(F)c3)CC2)CCN(C2CC2)CC1
• InChI: InChI=1S/C25H36N6O8S.C24H39FN4O5S.C24H40N4O5S.C23H33FN4O5S.C23H37FN4O4S.C21H29F5N4O6S.CH4.10ClH/c1-2-3-18-39-20-6-4-19(5-7-20)28-14-16-30(17-15-28)40(37,38)25(23(34)27-36)8-11-29(12-9-25)24(35)31-13-10-26-21(32)22(31)33;1-3-4-5-6-20-7-8-21(19-22(20)25)28-13-15-29(16-14-28)35(32,33)24(23(30)26-31)9-11-27(12-10-24)17-18-34-2;1-3-4-5-6-21-7-9-22(10-8-21)27-15-17-28(18-16-27)34(31,32)24(23(29)25-30)11-13-26(14-12-24)19-20-33-2;24-20-15-19(5-6-21(20)33-16-17-1-2-17)27-11-13-28(14-12-27)34(31,32)23(22(29)25-30)7-9-26(10-8-23)18-3-4-18;1-3-5-6-7-19-8-9-20(18-21(19)24)27-14-16-28(17-15-27)33(31,32)23(22(29)25-30)10-12-26(4-2)13-11-23;1-35-15-14-28-8-6-19(7-9-28,18(31)27-32)37(33,34)30-12-10-29(11-13-30)16-2-4-17(5-3-16)36-21(25,26)20(22,23)24;;;;;;;;;;;/h4-7,36H,2-3,8-18H2,1H3,(H,26,32)(H,27,34);7-8,19,31H,3-6,9-18H2,1-2H3,(H,26,30);7-10,30H,3-6,11-20H2,1-2H3,(H,25,29);5-6,15,17-18,30H,1-4,7-14,16H2,(H,25,29);8-9,18,30H,3-7,10-17H2,1-2H3,(H,25,29);2-5,32H,6-15H2,1H3,(H,27,31);1H4;10*1H
• InChIKey: PLAHYYGXADMDEI-UHFFFAOYSA-N
• XLogP: 14.04
• TPSA: 681.00 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 44
• Rotatable Bonds: 56
• Heavy Atoms: 224
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3514.44
LogP ≤ 5	14.04
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	44

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'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride?

The IUPAC name of 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride (CID 158058952) is 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride.

What is the SMILES notation for 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride?

The canonical SMILES for 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride is C.CCCCCc1ccc(N2CCN(S(=O)(=O)C3(C(=O)NO)CCN(CC)CC3)CC2)cc1F.CCCCCc1ccc(N2CCN(S(=O)(=O)C3(C(=O)NO)CCN(CCOC)CC3)CC2)cc1.CCCCCc1ccc(N2CCN(S(=O)(=O)C3(C(=O)NO)CCN(CCOC)CC3)CC2)cc1F.CCCCOc1ccc(N2CCN(S(=O)(=O)C3(C(=O)NO)CCN(C(=O)N4CCNC(=O)C4=O)CC3)CC2)cc1.COCCN1CCC(C(=O)NO)(S(=O)(=O)N2CCN(c3ccc(OC(F)(F)C(F)(F)F)cc3)CC2)CC1.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.O=C(NO)C1(S(=O)(=O)N2CCN(c3ccc(OCC4CC4)c(F)c3)CC2)CCN(C2CC2)CC1.

What is the InChIKey of 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride?

The InChIKey is PLAHYYGXADMDEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H36N6O8S.C24H39FN4O5S.C24H40N4O5S.C23H33FN4O5S.C23H37FN4O4S.C21H29F5N4O6S.CH4.10ClH/c1-2-3-18-39-20-6-4-19(5-7-20)28-14-16-30(17-15-28)40(37,38)25(23(34)27-36)8-11-29(12-9-25)24(35)31-13-10-26-21(32)22(31)33;1-3-4-5-6-20-7-8-21(19-22(20)25)28-13-15-29(16-14-28)35(32,33)24(23(30)26-31)9-11-27(12-10-24)17-18-34-2;1-3-4-5-6-21-7-9-22(10-8-21)27-15-17-28(18-16-27)34(31,32)24(23(29)25-30)11-13-26(14-12-24)19-20-33-2;24-20-15-19(5-6-21(20)33-16-17-1-2-17)27-11-13-28(14-12-27)34(31,32)23(22(29)25-30)7-9-26(10-8-23)18-3-4-18;1-3-5-6-7-19-8-9-20(18-21(19)24)27-14-16-28(17-15-27)33(31,32)23(22(29)25-30)10-12-26(4-2)13-11-23;1-35-15-14-28-8-6-19(7-9-28,18(31)27-32)37(33,34)30-12-10-29(11-13-30)16-2-4-17(5-3-16)36-21(25,26)20(22,23)24;;;;;;;;;;;/h4-7,36H,2-3,8-18H2,1H3,(H,26,32)(H,27,34);7-8,19,31H,3-6,9-18H2,1-2H3,(H,26,30);7-10,30H,3-6,11-20H2,1-2H3,(H,25,29);5-6,15,17-18,30H,1-4,7-14,16H2,(H,25,29);8-9,18,30H,3-7,10-17H2,1-2H3,(H,25,29);2-5,32H,6-15H2,1H3,(H,27,31);1H4;10*1H.

What are the key properties of 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride?

4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride has a molecular weight of 3514.44 g/mol, XLogP of 14.04, 56 rotatable bonds, 13 hydrogen bond donors, and 44 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-1-(2,3-dioxopiperazine-1-carbonyl)-N-hydroxypiperidine-4-carboxamide;1-cyclopropyl-4-[4-[4-(cyclopropylmethoxy)-3-fluorophenyl]piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;1-ethyl-4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxypiperidine-4-carboxamide;4-[4-(3-fluoro-4-pentylphenyl)piperazin-1-yl]sulfonyl-N-hydroxy-1-(2-methoxyethyl)piperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-[4-(1,1,2,2,2-pentafluoroethoxy)phenyl]piperazin-1-yl]sulfonylpiperidine-4-carboxamide;N-hydroxy-1-(2-methoxyethyl)-4-[4-(4-pentylphenyl)piperazin-1-yl]sulfonylpiperidine-4-carboxamide;methane;decahydrochloride is sourced from PubChem (CID 158058952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).