N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine

C112H128F2N16O9 — CID 160626123

About N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine

N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 160626123) has the molecular formula C112H128F2N16O9 and a molecular weight of 1880.35 g/mol. Its IUPAC name is N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

• Compound Name: N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine
• PubChem CID: 160626123
• Molecular Formula: C112H128F2N16O9
• Molecular Weight: 1880.35 g/mol
• Exact Mass: 1879.00
• IUPAC Name: N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine
• SMILES: CC(C)Oc1ccc(-c2cccc3nc(Cc4ccc(OCCCN5CCCCC5)cc4)nn23)cc1.CCN(CC)CCOc1cc(Cc2nc3cccc(-c4ccc(OC)cc4)n3n2)cc(F)c1F.CCN(CC)CCOc1ccc(Cc2nc3cccc(-c4ccc(OC)cc4)n3n2)cc1C.c1cc(-c2ccc3c(c2)OCCO3)n2nc(Cc3ccc(OCCCN4CCCCC4)cc3)nc2c1
• InChI: InChI=1S/C30H36N4O2.C29H32N4O3.C27H32N4O2.C26H28F2N4O2/c1-23(2)36-27-16-12-25(13-17-27)28-8-6-9-30-31-29(32-34(28)30)22-24-10-14-26(15-11-24)35-21-7-20-33-18-4-3-5-19-33;1-2-14-32(15-3-1)16-5-17-34-24-11-8-22(9-12-24)20-28-30-29-7-4-6-25(33(29)31-28)23-10-13-26-27(21-23)36-19-18-35-26;1-5-30(6-2)16-17-33-25-15-10-21(18-20(25)3)19-26-28-27-9-7-8-24(31(27)29-26)22-11-13-23(32-4)14-12-22;1-4-31(5-2)13-14-34-23-16-18(15-21(27)26(23)28)17-24-29-25-8-6-7-22(32(25)30-24)19-9-11-20(33-3)12-10-19/h6,8-17,23H,3-5,7,18-22H2,1-2H3;4,6-13,21H,1-3,5,14-20H2;7-15,18H,5-6,16-17,19H2,1-4H3;6-12,15-16H,4-5,13-14,17H2,1-3H3
• InChIKey: RHHYXCMXRRVDIL-UHFFFAOYSA-N
• XLogP: 21.06
• TPSA: 216.79 Ų
• H-Bond Acceptors: 25
• Rotatable Bonds: 38
• Heavy Atoms: 139
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1880.35
LogP ≤ 5	21.06
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine?

The IUPAC name of N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine (CID 160626123) is N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine.

What is the SMILES notation for N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine?

The canonical SMILES for N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine is CC(C)Oc1ccc(-c2cccc3nc(Cc4ccc(OCCCN5CCCCC5)cc4)nn23)cc1.CCN(CC)CCOc1cc(Cc2nc3cccc(-c4ccc(OC)cc4)n3n2)cc(F)c1F.CCN(CC)CCOc1ccc(Cc2nc3cccc(-c4ccc(OC)cc4)n3n2)cc1C.c1cc(-c2ccc3c(c2)OCCO3)n2nc(Cc3ccc(OCCCN4CCCCC4)cc3)nc2c1.

What is the InChIKey of N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine?

The InChIKey is RHHYXCMXRRVDIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H36N4O2.C29H32N4O3.C27H32N4O2.C26H28F2N4O2/c1-23(2)36-27-16-12-25(13-17-27)28-8-6-9-30-31-29(32-34(28)30)22-24-10-14-26(15-11-24)35-21-7-20-33-18-4-3-5-19-33;1-2-14-32(15-3-1)16-5-17-34-24-11-8-22(9-12-24)20-28-30-29-7-4-6-25(33(29)31-28)23-10-13-26-27(21-23)36-19-18-35-26;1-5-30(6-2)16-17-33-25-15-10-21(18-20(25)3)19-26-28-27-9-7-8-24(31(27)29-26)22-11-13-23(32-4)14-12-22;1-4-31(5-2)13-14-34-23-16-18(15-21(27)26(23)28)17-24-29-25-8-6-7-22(32(25)30-24)19-9-11-20(33-3)12-10-19/h6,8-17,23H,3-5,7,18-22H2,1-2H3;4,6-13,21H,1-3,5,14-20H2;7-15,18H,5-6,16-17,19H2,1-4H3;6-12,15-16H,4-5,13-14,17H2,1-3H3.

What are the key properties of N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine?

N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 1880.35 g/mol, XLogP of 21.06, 38 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-diethyl-2-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-2-methylphenoxy]ethanamine;2-[2,3-difluoro-5-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenoxy]-N,N-diethylethanamine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;2-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 160626123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).