3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide

C132H154Cl8N20O14S2 — CID 159971030

About 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide

3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide (PubChem CID 159971030) has the molecular formula C132H154Cl8N20O14S2 and a molecular weight of 2592.57 g/mol. Its IUPAC name is 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide.

Molecular Properties

• Compound Name: 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide
• PubChem CID: 159971030
• Molecular Formula: C132H154Cl8N20O14S2
• Molecular Weight: 2592.57 g/mol
• Exact Mass: 2586.89
• IUPAC Name: 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide
• SMILES: CC1CCCCN1C(=O)CC1CCN(c2ncc(Cl)cc2NC(=O)c2cccc(Cl)c2)CC1.CCC1CCN(C(=O)CC2CCN(c3ncc(Cl)cc3NC(=O)c3cccc(Cl)c3)CC2)CC1.C[C@H]1CCCCN1C(=O)CC1CCN(c2ncc(Cl)cc2NC(=O)c2cccc(Cl)c2)CC1.Cc1cccc(CNC(=O)CC2CCN(c3ncc(S(C)(=O)=O)cc3NC(=O)c3cccc(Cl)c3)CC2)c1.Cc1ccccc1CNC(=O)CC1CCN(c2ncc(S(C)(=O)=O)cc2NC(=O)c2cccc(Cl)c2)CC1
• InChI: InChI=1S/2C28H31ClN4O4S.C26H32Cl2N4O2.2C25H30Cl2N4O2/c1-19-5-3-6-21(13-19)17-30-26(34)14-20-9-11-33(12-10-20)27-25(16-24(18-31-27)38(2,36)37)32-28(35)22-7-4-8-23(29)15-22;1-19-6-3-4-7-22(19)17-30-26(34)14-20-10-12-33(13-11-20)27-25(16-24(18-31-27)38(2,36)37)32-28(35)21-8-5-9-23(29)15-21;1-2-18-6-10-31(11-7-18)24(33)14-19-8-12-32(13-9-19)25-23(16-22(28)17-29-25)30-26(34)20-4-3-5-21(27)15-20;2*1-17-5-2-3-10-31(17)23(32)13-18-8-11-30(12-9-18)24-22(15-21(27)16-28-24)29-25(33)19-6-4-7-20(26)14-19/h3-8,13,15-16,18,20H,9-12,14,17H2,1-2H3,(H,30,34)(H,32,35);3-9,15-16,18,20H,10-14,17H2,1-2H3,(H,30,34)(H,32,35);3-5,15-19H,2,6-14H2,1H3,(H,30,34);2*4,6-7,14-18H,2-3,5,8-13H2,1H3,(H,29,33)/t;;;17-;/m...0./s1
• InChIKey: OENWPKJIVYAAQM-WQRIQYTDSA-N
• XLogP: 26.44
• TPSA: 413.56 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 24
• Rotatable Bonds: 32
• Heavy Atoms: 176
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2592.57
LogP ≤ 5	26.44
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide?

The IUPAC name of 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide (CID 159971030) is 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide.

What is the SMILES notation for 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide?

The canonical SMILES for 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide is CC1CCCCN1C(=O)CC1CCN(c2ncc(Cl)cc2NC(=O)c2cccc(Cl)c2)CC1.CCC1CCN(C(=O)CC2CCN(c3ncc(Cl)cc3NC(=O)c3cccc(Cl)c3)CC2)CC1.C[C@H]1CCCCN1C(=O)CC1CCN(c2ncc(Cl)cc2NC(=O)c2cccc(Cl)c2)CC1.Cc1cccc(CNC(=O)CC2CCN(c3ncc(S(C)(=O)=O)cc3NC(=O)c3cccc(Cl)c3)CC2)c1.Cc1ccccc1CNC(=O)CC1CCN(c2ncc(S(C)(=O)=O)cc2NC(=O)c2cccc(Cl)c2)CC1.

What is the InChIKey of 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide?

The InChIKey is OENWPKJIVYAAQM-WQRIQYTDSA-N. The full InChI is InChI=1S/2C28H31ClN4O4S.C26H32Cl2N4O2.2C25H30Cl2N4O2/c1-19-5-3-6-21(13-19)17-30-26(34)14-20-9-11-33(12-10-20)27-25(16-24(18-31-27)38(2,36)37)32-28(35)22-7-4-8-23(29)15-22;1-19-6-3-4-7-22(19)17-30-26(34)14-20-10-12-33(13-11-20)27-25(16-24(18-31-27)38(2,36)37)32-28(35)21-8-5-9-23(29)15-21;1-2-18-6-10-31(11-7-18)24(33)14-19-8-12-32(13-9-19)25-23(16-22(28)17-29-25)30-26(34)20-4-3-5-21(27)15-20;2*1-17-5-2-3-10-31(17)23(32)13-18-8-11-30(12-9-18)24-22(15-21(27)16-28-24)29-25(33)19-6-4-7-20(26)14-19/h3-8,13,15-16,18,20H,9-12,14,17H2,1-2H3,(H,30,34)(H,32,35);3-9,15-16,18,20H,10-14,17H2,1-2H3,(H,30,34)(H,32,35);3-5,15-19H,2,6-14H2,1H3,(H,30,34);2*4,6-7,14-18H,2-3,5,8-13H2,1H3,(H,29,33)/t;;;17-;/m...0./s1.

What are the key properties of 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide?

3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide has a molecular weight of 2592.57 g/mol, XLogP of 26.44, 32 rotatable bonds, 7 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-N-[5-chloro-2-[4-[2-(4-ethylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide is sourced from PubChem (CID 159971030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).