6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one

C87H65Cl3F3N25O4 — CID 162246582

About 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one

6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one (PubChem CID 162246582) has the molecular formula C87H65Cl3F3N25O4 and a molecular weight of 1688.00 g/mol. Its IUPAC name is 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one.

Molecular Properties

• Compound Name: 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one
• PubChem CID: 162246582
• Molecular Formula: C87H65Cl3F3N25O4
• Molecular Weight: 1688.00 g/mol
• Exact Mass: 1685.47
• IUPAC Name: 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one
• SMILES: Cc1cc(-c2cc3c(=O)[nH][nH]c3cc2Cl)nc(Nc2n[nH]c3ccccc23)c1C.Cc1cc(Nc2nc(-c3cc4c(=O)[nH][nH]c4cc3Cl)cc3ccccc23)n[nH]1.O=c1[nH][nH]c2cc(C(F)(F)F)c(-c3cc(Nc4n[nH]c5ccccc45)c4cccnc4n3)cc12.O=c1[nH][nH]c2cc(Cl)c(-c3cc(Nc4n[nH]c5ccccc45)c4c(n3)CCCC4)cc12
• InChI: InChI=1S/C23H19ClN6O.C23H14F3N7O.C21H17ClN6O.C20H15ClN6O/c24-16-10-21-15(23(31)30-28-21)9-14(16)20-11-19(12-5-1-3-7-17(12)25-20)26-22-13-6-2-4-8-18(13)27-29-22;24-23(25,26)15-9-19-14(22(34)33-31-19)8-13(15)18-10-17(12-5-3-7-27-20(12)28-18)29-21-11-4-1-2-6-16(11)30-32-21;1-10-7-17(13-8-14-18(9-15(13)22)26-28-21(14)29)23-19(11(10)2)24-20-12-5-3-4-6-16(12)25-27-20;1-10-6-18(26-24-10)23-19-12-5-3-2-4-11(12)7-16(22-19)13-8-14-17(9-15(13)21)25-27-20(14)28/h2,4,6,8-11H,1,3,5,7H2,(H2,28,30,31)(H2,25,26,27,29);1-10H,(H2,31,33,34)(H2,27,28,29,30,32);3-9H,1-2H3,(H2,26,28,29)(H2,23,24,25,27);2-9H,1H3,(H2,25,27,28)(H2,22,23,24,26)
• InChIKey: ZXKLNUJIJHGXEI-UHFFFAOYSA-N
• XLogP: 19.48
• TPSA: 421.89 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 17
• Rotatable Bonds: 12
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1688.00
LogP ≤ 5	19.48
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one?

The IUPAC name of 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one (CID 162246582) is 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one.

What is the SMILES notation for 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one?

The canonical SMILES for 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one is Cc1cc(-c2cc3c(=O)[nH][nH]c3cc2Cl)nc(Nc2n[nH]c3ccccc23)c1C.Cc1cc(Nc2nc(-c3cc4c(=O)[nH][nH]c4cc3Cl)cc3ccccc23)n[nH]1.O=c1[nH][nH]c2cc(C(F)(F)F)c(-c3cc(Nc4n[nH]c5ccccc45)c4cccnc4n3)cc12.O=c1[nH][nH]c2cc(Cl)c(-c3cc(Nc4n[nH]c5ccccc45)c4c(n3)CCCC4)cc12.

What is the InChIKey of 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one?

The InChIKey is ZXKLNUJIJHGXEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClN6O.C23H14F3N7O.C21H17ClN6O.C20H15ClN6O/c24-16-10-21-15(23(31)30-28-21)9-14(16)20-11-19(12-5-1-3-7-17(12)25-20)26-22-13-6-2-4-8-18(13)27-29-22;24-23(25,26)15-9-19-14(22(34)33-31-19)8-13(15)18-10-17(12-5-3-7-27-20(12)28-18)29-21-11-4-1-2-6-16(11)30-32-21;1-10-7-17(13-8-14-18(9-15(13)22)26-28-21(14)29)23-19(11(10)2)24-20-12-5-3-4-6-16(12)25-27-20;1-10-6-18(26-24-10)23-19-12-5-3-2-4-11(12)7-16(22-19)13-8-14-17(9-15(13)21)25-27-20(14)28/h2,4,6,8-11H,1,3,5,7H2,(H2,28,30,31)(H2,25,26,27,29);1-10H,(H2,31,33,34)(H2,27,28,29,30,32);3-9H,1-2H3,(H2,26,28,29)(H2,23,24,25,27);2-9H,1H3,(H2,25,27,28)(H2,22,23,24,26).

What are the key properties of 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one?

6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one has a molecular weight of 1688.00 g/mol, XLogP of 19.48, 12 rotatable bonds, 16 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloro-5-[6-(1H-indazol-3-ylamino)-4,5-dimethyl-2-pyridinyl]-1,2-dihydroindazol-3-one;6-chloro-5-[4-(1H-indazol-3-ylamino)-5,6,7,8-tetrahydroquinolin-2-yl]-1,2-dihydroindazol-3-one;6-chloro-5-[1-[(5-methyl-1H-pyrazol-3-yl)amino]isoquinolin-3-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-1,8-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one is sourced from PubChem (CID 162246582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).