N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine

C128H135N35O5 — CID 157292422

About N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine

N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine (PubChem CID 157292422) has the molecular formula C128H135N35O5 and a molecular weight of 2243.73 g/mol. Its IUPAC name is N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine.

Molecular Properties

• Compound Name: N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine
• PubChem CID: 157292422
• Molecular Formula: C128H135N35O5
• Molecular Weight: 2243.73 g/mol
• Exact Mass: 2242.14
• IUPAC Name: N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine
• SMILES: C.CC(C)(C)NC(=O)c1cccc(-c2n[nH]c3ccc(-c4ncn[nH]4)cc23)c1.CCC(C)(C)c1nc(-c2ccc3[nH]nc(-c4ccc(C)cc4)c3c2)n[nH]1.CN(C)CCOc1ccc(-c2n[nH]c3ccc(-c4ncn[nH]4)cc23)cc1.COc1ccc2cc(-c3n[nH]c4ccc(-c5n[nH]c(CN6CCCC6)n5)cc34)ccc2c1.Cc1ccc(-c2n[nH]c3ccc(-c4n[nH]c(CN5CCCC5)n4)cc23)cc1.c1cc(OCCN2CCOCC2)cc(-c2n[nH]c3ccc(-c4ncn[nH]4)cc23)c1
• InChI: InChI=1S/C25H24N6O.C21H22N6O2.C21H22N6.C21H23N5.C20H20N6O.C19H20N6O.CH4/c1-32-20-8-6-16-12-18(5-4-17(16)13-20)24-21-14-19(7-9-22(21)27-29-24)25-26-23(28-30-25)15-31-10-2-3-11-31;1-2-15(12-17(3-1)29-11-8-27-6-9-28-10-7-27)20-18-13-16(21-22-14-23-26-21)4-5-19(18)24-25-20;1-14-4-6-15(7-5-14)20-17-12-16(8-9-18(17)23-25-20)21-22-19(24-26-21)13-27-10-2-3-11-27;1-5-21(3,4)20-22-19(25-26-20)15-10-11-17-16(12-15)18(24-23-17)14-8-6-13(2)7-9-14;1-20(2,3)23-19(27)14-6-4-5-12(9-14)17-15-10-13(18-21-11-22-26-18)7-8-16(15)24-25-17;1-25(2)9-10-26-15-6-3-13(4-7-15)18-16-11-14(19-20-12-21-24-19)5-8-17(16)22-23-18;/h4-9,12-14H,2-3,10-11,15H2,1H3,(H,27,29)(H,26,28,30);1-5,12-14H,6-11H2,(H,24,25)(H,22,23,26);4-9,12H,2-3,10-11,13H2,1H3,(H,23,25)(H,22,24,26);6-12H,5H2,1-4H3,(H,23,24)(H,22,25,26);4-11H,1-3H3,(H,23,27)(H,24,25)(H,21,22,26);3-8,11-12H,9-10H2,1-2H3,(H,22,23)(H,20,21,24);1H4
• InChIKey: BAYPNWASIKRHIQ-UHFFFAOYSA-N
• XLogP: 23.56
• TPSA: 500.48 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 27
• Rotatable Bonds: 28
• Heavy Atoms: 168
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2243.73
LogP ≤ 5	23.56
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine?

The IUPAC name of N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine (CID 157292422) is N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine.

What is the SMILES notation for N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine?

The canonical SMILES for N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine is C.CC(C)(C)NC(=O)c1cccc(-c2n[nH]c3ccc(-c4ncn[nH]4)cc23)c1.CCC(C)(C)c1nc(-c2ccc3[nH]nc(-c4ccc(C)cc4)c3c2)n[nH]1.CN(C)CCOc1ccc(-c2n[nH]c3ccc(-c4ncn[nH]4)cc23)cc1.COc1ccc2cc(-c3n[nH]c4ccc(-c5n[nH]c(CN6CCCC6)n5)cc34)ccc2c1.Cc1ccc(-c2n[nH]c3ccc(-c4n[nH]c(CN5CCCC5)n4)cc23)cc1.c1cc(OCCN2CCOCC2)cc(-c2n[nH]c3ccc(-c4ncn[nH]4)cc23)c1.

What is the InChIKey of N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine?

The InChIKey is BAYPNWASIKRHIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6O.C21H22N6O2.C21H22N6.C21H23N5.C20H20N6O.C19H20N6O.CH4/c1-32-20-8-6-16-12-18(5-4-17(16)13-20)24-21-14-19(7-9-22(21)27-29-24)25-26-23(28-30-25)15-31-10-2-3-11-31;1-2-15(12-17(3-1)29-11-8-27-6-9-28-10-7-27)20-18-13-16(21-22-14-23-26-21)4-5-19(18)24-25-20;1-14-4-6-15(7-5-14)20-17-12-16(8-9-18(17)23-25-20)21-22-19(24-26-21)13-27-10-2-3-11-27;1-5-21(3,4)20-22-19(25-26-20)15-10-11-17-16(12-15)18(24-23-17)14-8-6-13(2)7-9-14;1-20(2,3)23-19(27)14-6-4-5-12(9-14)17-15-10-13(18-21-11-22-26-18)7-8-16(15)24-25-17;1-25(2)9-10-26-15-6-3-13(4-7-15)18-16-11-14(19-20-12-21-24-19)5-8-17(16)22-23-18;/h4-9,12-14H,2-3,10-11,15H2,1H3,(H,27,29)(H,26,28,30);1-5,12-14H,6-11H2,(H,24,25)(H,22,23,26);4-9,12H,2-3,10-11,13H2,1H3,(H,23,25)(H,22,24,26);6-12H,5H2,1-4H3,(H,23,24)(H,22,25,26);4-11H,1-3H3,(H,23,27)(H,24,25)(H,21,22,26);3-8,11-12H,9-10H2,1-2H3,(H,22,23)(H,20,21,24);1H4.

What are the key properties of N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine?

N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine has a molecular weight of 2243.73 g/mol, XLogP of 23.56, 28 rotatable bonds, 13 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for N-tert-butyl-3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]benzamide;N,N-dimethyl-2-[4-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethanamine;methane;3-(6-methoxynaphthalen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;5-[5-(2-methylbutan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1H-indazole;3-(4-methylphenyl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole;4-[2-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenoxy]ethyl]morpholine is sourced from PubChem (CID 157292422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).