5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole

C80H73F5N20 — CID 157377319

About 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole

5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole (PubChem CID 157377319) has the molecular formula C80H73F5N20 and a molecular weight of 1409.59 g/mol. Its IUPAC name is 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole.

Molecular Properties

• Compound Name: 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole
• PubChem CID: 157377319
• Molecular Formula: C80H73F5N20
• Molecular Weight: 1409.59 g/mol
• Exact Mass: 1408.62
• IUPAC Name: 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole
• SMILES: CC(F)(F)c1cccc(-c2n[nH]c3ccc(-c4n[nH]c(CC5CC5)n4)cc23)c1.Cc1cc(-c2n[nH]c3ccc(-c4n[nH]c(CC(C)C)n4)cc23)ccc1F.Cc1cc(-c2n[nH]c3ccc(-c4n[nH]c(CC5CC5)n4)cc23)ccc1F.Fc1ccc(-c2n[nH]c3ccc(-c4n[nH]c(CC5CC5)n4)cc23)cc1
• InChI: InChI=1S/C21H19F2N5.C20H18FN5.C20H20FN5.C19H16FN5/c1-21(22,23)15-4-2-3-13(10-15)19-16-11-14(7-8-17(16)25-27-19)20-24-18(26-28-20)9-12-5-6-12;1-11-8-13(4-6-16(11)21)19-15-10-14(5-7-17(15)23-25-19)20-22-18(24-26-20)9-12-2-3-12;1-11(2)8-18-22-20(26-24-18)14-5-7-17-15(10-14)19(25-23-17)13-4-6-16(21)12(3)9-13;20-14-6-3-12(4-7-14)18-15-10-13(5-8-16(15)22-24-18)19-21-17(23-25-19)9-11-1-2-11/h2-4,7-8,10-12H,5-6,9H2,1H3,(H,25,27)(H,24,26,28);4-8,10,12H,2-3,9H2,1H3,(H,23,25)(H,22,24,26);4-7,9-11H,8H2,1-3H3,(H,23,25)(H,22,24,26);3-8,10-11H,1-2,9H2,(H,22,24)(H,21,23,25)
• InChIKey: BKLWHAIJEZTJQK-UHFFFAOYSA-N
• XLogP: 18.26
• TPSA: 281.00 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 12
• Rotatable Bonds: 17
• Heavy Atoms: 105
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1409.59
LogP ≤ 5	18.26
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole?

The IUPAC name of 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole (CID 157377319) is 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole.

What is the SMILES notation for 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole?

The canonical SMILES for 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole is CC(F)(F)c1cccc(-c2n[nH]c3ccc(-c4n[nH]c(CC5CC5)n4)cc23)c1.Cc1cc(-c2n[nH]c3ccc(-c4n[nH]c(CC(C)C)n4)cc23)ccc1F.Cc1cc(-c2n[nH]c3ccc(-c4n[nH]c(CC5CC5)n4)cc23)ccc1F.Fc1ccc(-c2n[nH]c3ccc(-c4n[nH]c(CC5CC5)n4)cc23)cc1.

What is the InChIKey of 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole?

The InChIKey is BKLWHAIJEZTJQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19F2N5.C20H18FN5.C20H20FN5.C19H16FN5/c1-21(22,23)15-4-2-3-13(10-15)19-16-11-14(7-8-17(16)25-27-19)20-24-18(26-28-20)9-12-5-6-12;1-11-8-13(4-6-16(11)21)19-15-10-14(5-7-17(15)23-25-19)20-22-18(24-26-20)9-12-2-3-12;1-11(2)8-18-22-20(26-24-18)14-5-7-17-15(10-14)19(25-23-17)13-4-6-16(21)12(3)9-13;20-14-6-3-12(4-7-14)18-15-10-13(5-8-16(15)22-24-18)19-21-17(23-25-19)9-11-1-2-11/h2-4,7-8,10-12H,5-6,9H2,1H3,(H,25,27)(H,24,26,28);4-8,10,12H,2-3,9H2,1H3,(H,23,25)(H,22,24,26);4-7,9-11H,8H2,1-3H3,(H,23,25)(H,22,24,26);3-8,10-11H,1-2,9H2,(H,22,24)(H,21,23,25).

What are the key properties of 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole?

5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole has a molecular weight of 1409.59 g/mol, XLogP of 18.26, 17 rotatable bonds, 8 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-[3-(1,1-difluoroethyl)phenyl]-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluoro-3-methylphenyl)-1H-indazole;5-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]-3-(4-fluorophenyl)-1H-indazole;3-(4-fluoro-3-methylphenyl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole is sourced from PubChem (CID 157377319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).