1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone

C55H60F7N15O4S — CID 161369980

About 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone

1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone (PubChem CID 161369980) has the molecular formula C55H60F7N15O4S and a molecular weight of 1160.24 g/mol. Its IUPAC name is 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone.

Molecular Properties

• Compound Name: 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone
• PubChem CID: 161369980
• Molecular Formula: C55H60F7N15O4S
• Molecular Weight: 1160.24 g/mol
• Exact Mass: 1159.46
• IUPAC Name: 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone
• SMILES: CC(=O)N1CCN(c2cc(C(F)(F)F)cc3[nH]ncc23)CC1.CC(=O)N1CCN(c2cc(F)cc3[nH]ncc23)CC1.CS(=O)(=O)N1CCN(c2cc(C(F)(F)F)cc3[nH]ncc23)CC1.c1ccc(CCNc2cccc3[nH]ncc23)cc1
• InChI: InChI=1S/C15H15N3.C14H15F3N4O.C13H15F3N4O2S.C13H15FN4O/c1-2-5-12(6-3-1)9-10-16-14-7-4-8-15-13(14)11-17-18-15;1-9(22)20-2-4-21(5-3-20)13-7-10(14(15,16)17)6-12-11(13)8-18-19-12;1-23(21,22)20-4-2-19(3-5-20)12-7-9(13(14,15)16)6-11-10(12)8-17-18-11;1-9(19)17-2-4-18(5-3-17)13-7-10(14)6-12-11(13)8-15-16-12/h1-8,11,16H,9-10H2,(H,17,18);6-8H,2-5H2,1H3,(H,18,19);6-8H,2-5H2,1H3,(H,17,18);6-8H,2-5H2,1H3,(H,15,16)
• InChIKey: VQIHPPXIPHQAQC-UHFFFAOYSA-N
• XLogP: 8.50
• TPSA: 214.47 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 12
• Rotatable Bonds: 8
• Heavy Atoms: 82
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1160.24
LogP ≤ 5	8.50
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone?

The IUPAC name of 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone (CID 161369980) is 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone.

What is the SMILES notation for 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone?

The canonical SMILES for 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone is CC(=O)N1CCN(c2cc(C(F)(F)F)cc3[nH]ncc23)CC1.CC(=O)N1CCN(c2cc(F)cc3[nH]ncc23)CC1.CS(=O)(=O)N1CCN(c2cc(C(F)(F)F)cc3[nH]ncc23)CC1.c1ccc(CCNc2cccc3[nH]ncc23)cc1.

What is the InChIKey of 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone?

The InChIKey is VQIHPPXIPHQAQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3.C14H15F3N4O.C13H15F3N4O2S.C13H15FN4O/c1-2-5-12(6-3-1)9-10-16-14-7-4-8-15-13(14)11-17-18-15;1-9(22)20-2-4-21(5-3-20)13-7-10(14(15,16)17)6-12-11(13)8-18-19-12;1-23(21,22)20-4-2-19(3-5-20)12-7-9(13(14,15)16)6-11-10(12)8-17-18-11;1-9(19)17-2-4-18(5-3-17)13-7-10(14)6-12-11(13)8-15-16-12/h1-8,11,16H,9-10H2,(H,17,18);6-8H,2-5H2,1H3,(H,18,19);6-8H,2-5H2,1H3,(H,17,18);6-8H,2-5H2,1H3,(H,15,16).

What are the key properties of 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone?

1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone has a molecular weight of 1160.24 g/mol, XLogP of 8.50, 8 rotatable bonds, 5 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-(6-fluoro-1H-indazol-4-yl)piperazin-1-yl]ethanone;4-(4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole;N-(2-phenylethyl)-1H-indazol-4-amine;1-[4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone is sourced from PubChem (CID 161369980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).