2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine

C150H234N8O18 — CID 157079059

About 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine

2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine (PubChem CID 157079059) has the molecular formula C150H234N8O18 and a molecular weight of 2437.56 g/mol. Its IUPAC name is 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine.

Molecular Properties

• Compound Name: 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine
• PubChem CID: 157079059
• Molecular Formula: C150H234N8O18
• Molecular Weight: 2437.56 g/mol
• Exact Mass: 2435.76
• IUPAC Name: 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine
• SMILES: CC(C)(C)OCCCCC#Cc1ccc(OCCCOC(C)(C)C)nc1.CC(C)(C)OCCCOc1ccc(C#CCOC2CN(C(C)(C)C)C2)nc1.CC(C)(C)OCCCc1cccc(N2CCC(OC3CC(OC(C)(C)C)C3)CC2)c1.Cc1ccc(C#CCOC(C)(C)C)cc1N1CCC(OC2CC(OC(C)(C)C)C2)CC1.Cc1ccc(C#CCOC(C)(C)C)cc1N1CCC(OC2CC(OC(C)(C)C)C2)CC1.Cc1cnc(C#CCOC(C)(C)C)cc1N1CCC(OC2CC(OC(C)(C)C)C2)CC1
• InChI: InChI=1S/2C27H41NO3.C26H40N2O3.C26H43NO3.C22H34N2O3.C22H35NO3/c2*1-20-10-11-21(9-8-16-29-26(2,3)4)17-25(20)28-14-12-22(13-15-28)30-23-18-24(19-23)31-27(5,6)7;1-19-18-27-20(9-8-14-29-25(2,3)4)15-24(19)28-12-10-21(11-13-28)30-22-16-23(17-22)31-26(5,6)7;1-25(2,3)28-16-8-10-20-9-7-11-21(17-20)27-14-12-22(13-15-27)29-23-18-24(19-23)30-26(4,5)6;1-21(2,3)24-16-20(17-24)26-12-7-9-18-10-11-19(15-23-18)25-13-8-14-27-22(4,5)6;1-21(2,3)25-16-10-8-7-9-12-19-13-14-20(23-18-19)24-15-11-17-26-22(4,5)6/h2*10-11,17,22-24H,12-16,18-19H2,1-7H3;15,18,21-23H,10-14,16-17H2,1-7H3;7,9,11,17,22-24H,8,10,12-16,18-19H2,1-6H3;10-11,15,20H,8,12-14,16-17H2,1-6H3;13-14,18H,7-8,10-11,15-17H2,1-6H3
• InChIKey: ADHUBZKIYLKYRP-UHFFFAOYSA-N
• XLogP: 30.16
• TPSA: 221.01 Ų
• H-Bond Acceptors: 26
• Rotatable Bonds: 39
• Heavy Atoms: 176
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2437.56
LogP ≤ 5	30.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine?

The IUPAC name of 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine (CID 157079059) is 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine.

What is the SMILES notation for 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine?

The canonical SMILES for 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine is CC(C)(C)OCCCCC#Cc1ccc(OCCCOC(C)(C)C)nc1.CC(C)(C)OCCCOc1ccc(C#CCOC2CN(C(C)(C)C)C2)nc1.CC(C)(C)OCCCc1cccc(N2CCC(OC3CC(OC(C)(C)C)C3)CC2)c1.Cc1ccc(C#CCOC(C)(C)C)cc1N1CCC(OC2CC(OC(C)(C)C)C2)CC1.Cc1ccc(C#CCOC(C)(C)C)cc1N1CCC(OC2CC(OC(C)(C)C)C2)CC1.Cc1cnc(C#CCOC(C)(C)C)cc1N1CCC(OC2CC(OC(C)(C)C)C2)CC1.

What is the InChIKey of 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine?

The InChIKey is ADHUBZKIYLKYRP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C27H41NO3.C26H40N2O3.C26H43NO3.C22H34N2O3.C22H35NO3/c2*1-20-10-11-21(9-8-16-29-26(2,3)4)17-25(20)28-14-12-22(13-15-28)30-23-18-24(19-23)31-27(5,6)7;1-19-18-27-20(9-8-14-29-25(2,3)4)15-24(19)28-12-10-21(11-13-28)30-22-16-23(17-22)31-26(5,6)7;1-25(2,3)28-16-8-10-20-9-7-11-21(17-20)27-14-12-22(13-15-27)29-23-18-24(19-23)30-26(4,5)6;1-21(2,3)24-16-20(17-24)26-12-7-9-18-10-11-19(15-23-18)25-13-8-14-27-22(4,5)6;1-21(2,3)25-16-10-8-7-9-12-19-13-14-20(23-18-19)24-15-11-17-26-22(4,5)6/h2*10-11,17,22-24H,12-16,18-19H2,1-7H3;15,18,21-23H,10-14,16-17H2,1-7H3;7,9,11,17,22-24H,8,10,12-16,18-19H2,1-6H3;10-11,15,20H,8,12-14,16-17H2,1-6H3;13-14,18H,7-8,10-11,15-17H2,1-6H3.

What are the key properties of 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine?

2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine has a molecular weight of 2437.56 g/mol, XLogP of 30.16, 39 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-(1-tert-butylazetidin-3-yl)oxyprop-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;5-methyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;bis(1-[2-methyl-5-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]phenyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine);4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[3-[3-[(2-methylpropan-2-yl)oxy]propyl]phenyl]piperidine;5-[6-[(2-methylpropan-2-yl)oxy]hex-1-ynyl]-2-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine is sourced from PubChem (CID 157079059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).