6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one

C102H90N36O10 — CID 158729706

About 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one

6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one (PubChem CID 158729706) has the molecular formula C102H90N36O10 and a molecular weight of 1980.08 g/mol. Its IUPAC name is 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one.

Molecular Properties

• Compound Name: 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one
• PubChem CID: 158729706
• Molecular Formula: C102H90N36O10
• Molecular Weight: 1980.08 g/mol
• Exact Mass: 1978.76
• IUPAC Name: 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one
• SMILES: Cc1cc(Nc2cc(N3CCN(C)CC3)nc(Oc3ccc4c(=O)[nH][nH]c4c3)n2)n[nH]1.Cc1cc(Nc2cc(Oc3ccc4c(=O)[nH][nH]c4c3)nc3ccccc23)n[nH]1.Cc1cc(Nc2nc(Oc3ccc4c(=O)[nH][nH]c4c3)nc3ccccc23)n[nH]1.Cc1cccc(-c2cc(Nc3cc(C)[nH]n3)nc(Oc3ccc4c(=O)[nH][nH]c4c3)n2)c1.O=c1[nH][nH]c2cc(Oc3nc(Nc4cc(C5CC5)[nH]n4)c4ccccc4n3)ccc12
• InChI: InChI=1S/C22H19N7O2.C21H17N7O2.C20H23N9O2.C20H16N6O2.C19H15N7O2/c1-12-4-3-5-14(8-12)17-11-19(24-20-9-13(2)26-28-20)25-22(23-17)31-15-6-7-16-18(10-15)27-29-21(16)30;29-20-14-8-7-12(9-17(14)26-28-20)30-21-22-15-4-2-1-3-13(15)19(24-21)23-18-10-16(25-27-18)11-5-6-11;1-12-9-17(26-24-12)21-16-11-18(29-7-5-28(2)6-8-29)23-20(22-16)31-13-3-4-14-15(10-13)25-27-19(14)30;1-11-8-18(25-23-11)21-16-10-19(22-15-5-3-2-4-13(15)16)28-12-6-7-14-17(9-12)24-26-20(14)27;1-10-8-16(25-23-10)21-17-12-4-2-3-5-14(12)20-19(22-17)28-11-6-7-13-15(9-11)24-26-18(13)27/h3-11H,1-2H3,(H2,27,29,30)(H2,23,24,25,26,28);1-4,7-11H,5-6H2,(H2,26,28,29)(H2,22,23,24,25,27);3-4,9-11H,5-8H2,1-2H3,(H2,25,27,30)(H2,21,22,23,24,26);2-10H,1H3,(H2,24,26,27)(H2,21,22,23,25);2-9H,1H3,(H2,24,26,27)(H2,20,21,22,23,25)
• InChIKey: IKYBVJFMEDESSB-UHFFFAOYSA-N
• XLogP: 17.43
• TPSA: 615.44 Ų
• H-Bond Donors: 20
• H-Bond Acceptors: 31
• Rotatable Bonds: 23
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1980.08
LogP ≤ 5	17.43
H-Bond Donors ≤ 5	20
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one?

The IUPAC name of 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one (CID 158729706) is 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one.

What is the SMILES notation for 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one?

The canonical SMILES for 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one is Cc1cc(Nc2cc(N3CCN(C)CC3)nc(Oc3ccc4c(=O)[nH][nH]c4c3)n2)n[nH]1.Cc1cc(Nc2cc(Oc3ccc4c(=O)[nH][nH]c4c3)nc3ccccc23)n[nH]1.Cc1cc(Nc2nc(Oc3ccc4c(=O)[nH][nH]c4c3)nc3ccccc23)n[nH]1.Cc1cccc(-c2cc(Nc3cc(C)[nH]n3)nc(Oc3ccc4c(=O)[nH][nH]c4c3)n2)c1.O=c1[nH][nH]c2cc(Oc3nc(Nc4cc(C5CC5)[nH]n4)c4ccccc4n3)ccc12.

What is the InChIKey of 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one?

The InChIKey is IKYBVJFMEDESSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N7O2.C21H17N7O2.C20H23N9O2.C20H16N6O2.C19H15N7O2/c1-12-4-3-5-14(8-12)17-11-19(24-20-9-13(2)26-28-20)25-22(23-17)31-15-6-7-16-18(10-15)27-29-21(16)30;29-20-14-8-7-12(9-17(14)26-28-20)30-21-22-15-4-2-1-3-13(15)19(24-21)23-18-10-16(25-27-18)11-5-6-11;1-12-9-17(26-24-12)21-16-11-18(29-7-5-28(2)6-8-29)23-20(22-16)31-13-3-4-14-15(10-13)25-27-19(14)30;1-11-8-18(25-23-11)21-16-10-19(22-15-5-3-2-4-13(15)16)28-12-6-7-14-17(9-12)24-26-20(14)27;1-10-8-16(25-23-10)21-17-12-4-2-3-5-14(12)20-19(22-17)28-11-6-7-13-15(9-11)24-26-18(13)27/h3-11H,1-2H3,(H2,27,29,30)(H2,23,24,25,26,28);1-4,7-11H,5-6H2,(H2,26,28,29)(H2,22,23,24,25,27);3-4,9-11H,5-8H2,1-2H3,(H2,25,27,30)(H2,21,22,23,24,26);2-10H,1H3,(H2,24,26,27)(H2,21,22,23,25);2-9H,1H3,(H2,24,26,27)(H2,20,21,22,23,25).

What are the key properties of 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one?

6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one has a molecular weight of 1980.08 g/mol, XLogP of 17.43, 23 rotatable bonds, 20 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]oxy-1,2-dihydroindazol-3-one;6-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinolin-2-yl]oxy-1,2-dihydroindazol-3-one is sourced from PubChem (CID 158729706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).