2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine

C123H147Cl5N22 — CID 157147710

About 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine

2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine (PubChem CID 157147710) has the molecular formula C123H147Cl5N22 and a molecular weight of 2110.95 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine.

Molecular Properties

• Compound Name: 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine
• PubChem CID: 157147710
• Molecular Formula: C123H147Cl5N22
• Molecular Weight: 2110.95 g/mol
• Exact Mass: 2107.06
• IUPAC Name: 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine
• SMILES: Clc1ccc(C(=C2CCN(CCCCCCc3cnc[nH]3)CC2)c2ccccn2)cc1.Clc1ccc(C(=C2CCN(CCCCCc3cnc[nH]3)CC2)c2ccccn2)cc1.Clc1ccc(C(=C2CCN(CCCCc3cnc[nH]3)CC2)c2ccccn2)cc1.Clc1ccc(C(CCN2CCN(CCCCc3cnc[nH]3)CC2)c2ccccn2)cc1.Clc1ccc(C(c2ccccn2)N2CCN(CCCCc3cnc[nH]3)CC2)cc1
• InChI: InChI=1S/C26H31ClN4.C25H32ClN5.C25H29ClN4.C24H27ClN4.C23H28ClN5/c27-23-11-9-21(10-12-23)26(25-8-4-5-15-29-25)22-13-17-31(18-14-22)16-6-2-1-3-7-24-19-28-20-30-24;26-22-9-7-21(8-10-22)24(25-6-1-3-12-28-25)11-14-31-17-15-30(16-18-31)13-4-2-5-23-19-27-20-29-23;26-22-10-8-20(9-11-22)25(24-7-3-4-14-28-24)21-12-16-30(17-13-21)15-5-1-2-6-23-18-27-19-29-23;25-21-9-7-19(8-10-21)24(23-6-1-3-13-27-23)20-11-15-29(16-12-20)14-4-2-5-22-17-26-18-28-22;24-20-9-7-19(8-10-20)23(22-6-1-3-11-26-22)29-15-13-28(14-16-29)12-4-2-5-21-17-25-18-27-21/h4-5,8-12,15,19-20H,1-3,6-7,13-14,16-18H2,(H,28,30);1,3,6-10,12,19-20,24H,2,4-5,11,13-18H2,(H,27,29);3-4,7-11,14,18-19H,1-2,5-6,12-13,15-17H2,(H,27,29);1,3,6-10,13,17-18H,2,4-5,11-12,14-16H2,(H,26,28);1,3,6-11,17-18,23H,2,4-5,12-16H2,(H,25,27)
• InChIKey: AKWWHSFOAGTDJD-UHFFFAOYSA-N
• XLogP: 26.11
• TPSA: 230.53 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 17
• Rotatable Bonds: 42
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2110.95
LogP ≤ 5	26.11
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine?

The IUPAC name of 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine (CID 157147710) is 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine.

What is the SMILES notation for 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine?

The canonical SMILES for 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine is Clc1ccc(C(=C2CCN(CCCCCCc3cnc[nH]3)CC2)c2ccccn2)cc1.Clc1ccc(C(=C2CCN(CCCCCc3cnc[nH]3)CC2)c2ccccn2)cc1.Clc1ccc(C(=C2CCN(CCCCc3cnc[nH]3)CC2)c2ccccn2)cc1.Clc1ccc(C(CCN2CCN(CCCCc3cnc[nH]3)CC2)c2ccccn2)cc1.Clc1ccc(C(c2ccccn2)N2CCN(CCCCc3cnc[nH]3)CC2)cc1.

What is the InChIKey of 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine?

The InChIKey is AKWWHSFOAGTDJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H31ClN4.C25H32ClN5.C25H29ClN4.C24H27ClN4.C23H28ClN5/c27-23-11-9-21(10-12-23)26(25-8-4-5-15-29-25)22-13-17-31(18-14-22)16-6-2-1-3-7-24-19-28-20-30-24;26-22-9-7-21(8-10-22)24(25-6-1-3-12-28-25)11-14-31-17-15-30(16-18-31)13-4-2-5-23-19-27-20-29-23;26-22-10-8-20(9-11-22)25(24-7-3-4-14-28-24)21-12-16-30(17-13-21)15-5-1-2-6-23-18-27-19-29-23;25-21-9-7-19(8-10-21)24(23-6-1-3-13-27-23)20-11-15-29(16-12-20)14-4-2-5-22-17-26-18-28-22;24-20-9-7-19(8-10-20)23(22-6-1-3-11-26-22)29-15-13-28(14-16-29)12-4-2-5-21-17-25-18-27-21/h4-5,8-12,15,19-20H,1-3,6-7,13-14,16-18H2,(H,28,30);1,3,6-10,12,19-20,24H,2,4-5,11,13-18H2,(H,27,29);3-4,7-11,14,18-19H,1-2,5-6,12-13,15-17H2,(H,27,29);1,3,6-10,13,17-18H,2,4-5,11-12,14-16H2,(H,26,28);1,3,6-11,17-18,23H,2,4-5,12-16H2,(H,25,27).

What are the key properties of 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine?

2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine has a molecular weight of 2110.95 g/mol, XLogP of 26.11, 42 rotatable bonds, 5 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(4-chlorophenyl)-[1-[4-(1H-imidazol-5-yl)butyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[6-(1H-imidazol-5-yl)hexyl]piperidin-4-ylidene]methyl]pyridine;2-[(4-chlorophenyl)-[1-[5-(1H-imidazol-5-yl)pentyl]piperidin-4-ylidene]methyl]pyridine;1-[(4-chlorophenyl)-pyridin-2-ylmethyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine;1-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-4-[4-(1H-imidazol-5-yl)butyl]piperazine is sourced from PubChem (CID 157147710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).