3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole

C114H126N32O6S2 — CID 160611433

IUPAC3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole
SMILESCC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCCC(c5ccncn5)C4)c3)c2c1.CC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCN(c5ncccn5)CC4)c3)c2c1.CC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCN(c5nccs5)CC4)c3)c2c1.Cc1ncc(N2CCN(c3cc(-c4n[nH]c5ccc(OC(C)C)cc45)ccn3)CC2)s1.Cc1nonc1N1CCN(c2cc(-c3n[nH]c4ccc(OC(C)C)cc34)ccn2)CC1
InChIInChI=1S/C24H26N6O.C23H25N7O.C23H26N6OS.C22H25N7O2.C22H24N6OS/c1-16(2)31-19-5-6-22-20(13-19)24(29-28-22)17-7-10-26-23(12-17)30-11-3-4-18(14-30)21-8-9-25-15-27-21;1-16(2)31-18-4-5-20-19(15-18)22(28-27-20)17-6-9-24-21(14-17)29-10-12-30(13-11-29)23-25-7-3-8-26-23;1-15(2)30-18-4-5-20-19(13-18)23(27-26-20)17-6-7-24-21(12-17)28-8-10-29(11-9-28)22-14-25-16(3)31-22;1-14(2)30-17-4-5-19-18(13-17)21(25-24-19)16-6-7-23-20(12-16)28-8-10-29(11-9-28)22-15(3)26-31-27-22;1-15(2)29-17-3-4-19-18(14-17)21(26-25-19)16-5-6-23-20(13-16)27-8-10-28(11-9-27)22-24-7-12-30-22/h5-10,12-13,15-16,18H,3-4,11,14H2,1-2H3,(H,28,29);3-9,14-16H,10-13H2,1-2H3,(H,27,28);4-7,12-15H,8-11H2,1-3H3,(H,26,27);4-7,12-14H,8-11H2,1-3H3,(H,24,25);3-7,12-15H,8-11H2,1-2H3,(H,25,26)
InChIKeyRFNOLKMLMQDDRV-UHFFFAOYSA-N
MW2104.61 g/mol
LogP20.24
Rot. Bonds25

About 3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole

3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole (PubChem CID 160611433) has the molecular formula C114H126N32O6S2 and a molecular weight of 2104.61 g/mol. Its IUPAC name is 3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole.

Molecular Properties

Compound Name3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole
PubChem CID160611433
Molecular FormulaC114H126N32O6S2
Molecular Weight2104.61 g/mol
Exact Mass2103.00
IUPAC Name3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole
SMILESCC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCCC(c5ccncn5)C4)c3)c2c1.CC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCN(c5ncccn5)CC4)c3)c2c1.CC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCN(c5nccs5)CC4)c3)c2c1.Cc1ncc(N2CCN(c3cc(-c4n[nH]c5ccc(OC(C)C)cc45)ccn3)CC2)s1.Cc1nonc1N1CCN(c2cc(-c3n[nH]c4ccc(OC(C)C)cc34)ccn2)CC1
InChIInChI=1S/C24H26N6O.C23H25N7O.C23H26N6OS.C22H25N7O2.C22H24N6OS/c1-16(2)31-19-5-6-22-20(13-19)24(29-28-22)17-7-10-26-23(12-17)30-11-3-4-18(14-30)21-8-9-25-15-27-21;1-16(2)31-18-4-5-20-19(15-18)22(28-27-20)17-6-9-24-21(14-17)29-10-12-30(13-11-29)23-25-7-3-8-26-23;1-15(2)30-18-4-5-20-19(13-18)23(27-26-20)17-6-7-24-21(12-17)28-8-10-29(11-9-28)22-14-25-16(3)31-22;1-14(2)30-17-4-5-19-18(13-17)21(25-24-19)16-6-7-23-20(12-16)28-8-10-29(11-9-28)22-15(3)26-31-27-22;1-15(2)29-17-3-4-19-18(14-17)21(26-25-19)16-5-6-23-20(13-16)27-8-10-28(11-9-27)22-24-7-12-30-22/h5-10,12-13,15-16,18H,3-4,11,14H2,1-2H3,(H,28,29);3-9,14-16H,10-13H2,1-2H3,(H,27,28);4-7,12-15H,8-11H2,1-3H3,(H,26,27);4-7,12-14H,8-11H2,1-3H3,(H,24,25);3-7,12-15H,8-11H2,1-2H3,(H,25,26)
InChIKeyRFNOLKMLMQDDRV-UHFFFAOYSA-N
XLogP20.24
TPSA399.42 Ų
H-Bond Donors5
H-Bond Acceptors35
Rotatable Bonds25
Heavy Atoms154
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002104.61
LogP ≤ 520.24
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1035

Analyze 3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole?
The IUPAC name of 3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole (CID 160611433) is 3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole.
What is the SMILES notation for 3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole?
The canonical SMILES for 3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole is CC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCCC(c5ccncn5)C4)c3)c2c1.CC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCN(c5ncccn5)CC4)c3)c2c1.CC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCN(c5nccs5)CC4)c3)c2c1.Cc1ncc(N2CCN(c3cc(-c4n[nH]c5ccc(OC(C)C)cc45)ccn3)CC2)s1.Cc1nonc1N1CCN(c2cc(-c3n[nH]c4ccc(OC(C)C)cc34)ccn2)CC1.
What is the InChIKey of 3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole?
The InChIKey is RFNOLKMLMQDDRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N6O.C23H25N7O.C23H26N6OS.C22H25N7O2.C22H24N6OS/c1-16(2)31-19-5-6-22-20(13-19)24(29-28-22)17-7-10-26-23(12-17)30-11-3-4-18(14-30)21-8-9-25-15-27-21;1-16(2)31-18-4-5-20-19(15-18)22(28-27-20)17-6-9-24-21(14-17)29-10-12-30(13-11-29)23-25-7-3-8-26-23;1-15(2)30-18-4-5-20-19(13-18)23(27-26-20)17-6-7-24-21(12-17)28-8-10-29(11-9-28)22-14-25-16(3)31-22;1-14(2)30-17-4-5-19-18(13-17)21(25-24-19)16-6-7-23-20(12-16)28-8-10-29(11-9-28)22-15(3)26-31-27-22;1-15(2)29-17-3-4-19-18(14-17)21(26-25-19)16-5-6-23-20(13-16)27-8-10-28(11-9-27)22-24-7-12-30-22/h5-10,12-13,15-16,18H,3-4,11,14H2,1-2H3,(H,28,29);3-9,14-16H,10-13H2,1-2H3,(H,27,28);4-7,12-15H,8-11H2,1-3H3,(H,26,27);4-7,12-14H,8-11H2,1-3H3,(H,24,25);3-7,12-15H,8-11H2,1-2H3,(H,25,26).
What are the key properties of 3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole?
3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole has a molecular weight of 2104.61 g/mol, XLogP of 20.24, 25 rotatable bonds, 5 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,2,5-oxadiazole;2-methyl-5-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;2-[4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-1-yl]-1,3-thiazole;5-propan-2-yloxy-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)-4-pyridinyl]-1H-indazole;5-propan-2-yloxy-3-[2-(3-pyrimidin-4-ylpiperidin-1-yl)-4-pyridinyl]-1H-indazole is sourced from PubChem (CID 160611433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).