7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine

C90H75F3N22 — CID 157227647

About 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine

7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine (PubChem CID 157227647) has the molecular formula C90H75F3N22 and a molecular weight of 1521.74 g/mol. Its IUPAC name is 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine.

Molecular Properties

• Compound Name: 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine
• PubChem CID: 157227647
• Molecular Formula: C90H75F3N22
• Molecular Weight: 1521.74 g/mol
• Exact Mass: 1520.65
• IUPAC Name: 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine
• SMILES: Cc1[nH]nc2ccc(-c3nc4ccc5[nH]nc(C#N)c5c4c4c3CCCC4)cc12.Cc1[nH]nc2ccc(-c3nc4ccc5[nH]nc(N)c5c4c4c3CCCC4)cc12.Cc1[nH]nc2ccc(-c3nc4ccc5[nH]ncc5c4c4c3CCCC4)cc12.Cc1[nH]nc2ccc3nc(-c4ccc5n[nH]c(C(F)(F)F)c5c4)c4c(c3c12)CCCC4
• InChI: InChI=1S/C23H18F3N5.C23H18N6.C22H20N6.C22H19N5/c1-11-19-18(30-28-11)9-8-17-20(19)13-4-2-3-5-14(13)21(27-17)12-6-7-16-15(10-12)22(31-29-16)23(24,25)26;1-12-16-10-13(6-7-17(16)27-26-12)23-15-5-3-2-4-14(15)21-18(25-23)8-9-19-22(21)20(11-24)29-28-19;1-11-15-10-12(6-7-16(15)26-25-11)21-14-5-3-2-4-13(14)19-17(24-21)8-9-18-20(19)22(23)28-27-18;1-12-16-10-13(6-7-18(16)27-25-12)22-15-5-3-2-4-14(15)21-17-11-23-26-19(17)8-9-20(21)24-22/h6-10H,2-5H2,1H3,(H,28,30)(H,29,31);6-10H,2-5H2,1H3,(H,26,27)(H,28,29);6-10H,2-5H2,1H3,(H,25,26)(H3,23,27,28);6-11H,2-5H2,1H3,(H,23,26)(H,25,27)
• InChIKey: ATSLRPNVSSSXKQ-UHFFFAOYSA-N
• XLogP: 19.84
• TPSA: 330.81 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 14
• Rotatable Bonds: 4
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1521.74
LogP ≤ 5	19.84
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine?

The IUPAC name of 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine (CID 157227647) is 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine.

What is the SMILES notation for 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine?

The canonical SMILES for 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine is Cc1[nH]nc2ccc(-c3nc4ccc5[nH]nc(C#N)c5c4c4c3CCCC4)cc12.Cc1[nH]nc2ccc(-c3nc4ccc5[nH]nc(N)c5c4c4c3CCCC4)cc12.Cc1[nH]nc2ccc(-c3nc4ccc5[nH]ncc5c4c4c3CCCC4)cc12.Cc1[nH]nc2ccc3nc(-c4ccc5n[nH]c(C(F)(F)F)c5c4)c4c(c3c12)CCCC4.

What is the InChIKey of 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine?

The InChIKey is ATSLRPNVSSSXKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18F3N5.C23H18N6.C22H20N6.C22H19N5/c1-11-19-18(30-28-11)9-8-17-20(19)13-4-2-3-5-14(13)21(27-17)12-6-7-16-15(10-12)22(31-29-16)23(24,25)26;1-12-16-10-13(6-7-17(16)27-26-12)23-15-5-3-2-4-14(15)21-18(25-23)8-9-19-22(21)20(11-24)29-28-19;1-11-15-10-12(6-7-16(15)26-25-11)21-14-5-3-2-4-13(14)19-17(24-21)8-9-18-20(19)22(23)28-27-18;1-12-16-10-13(6-7-18(16)27-25-12)22-15-5-3-2-4-14(15)21-17-11-23-26-19(17)8-9-20(21)24-22/h6-10H,2-5H2,1H3,(H,28,30)(H,29,31);6-10H,2-5H2,1H3,(H,26,27)(H,28,29);6-10H,2-5H2,1H3,(H,25,26)(H3,23,27,28);6-11H,2-5H2,1H3,(H,23,26)(H,25,27).

What are the key properties of 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine?

7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine has a molecular weight of 1521.74 g/mol, XLogP of 19.84, 4 rotatable bonds, 9 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-1-amine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(3-methyl-2H-indazol-5-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine-1-carbonitrile;1-methyl-7-[3-(trifluoromethyl)-2H-indazol-5-yl]-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine is sourced from PubChem (CID 157227647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).