1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol

C93H135Cl5N16O15S5 — CID 159601263

About 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol

1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol (PubChem CID 159601263) has the molecular formula C93H135Cl5N16O15S5 and a molecular weight of 2054.80 g/mol. Its IUPAC name is 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol.

Molecular Properties

• Compound Name: 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol
• PubChem CID: 159601263
• Molecular Formula: C93H135Cl5N16O15S5
• Molecular Weight: 2054.80 g/mol
• Exact Mass: 2050.73
• IUPAC Name: 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol
• SMILES: CC(C)(C1CCN(S(=O)(=O)C2CC2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC(C)S(=O)(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1.CCCS(=O)(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1.CCS(=O)(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1.CN(C)S(=O)(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1
• InChI: InChI=1S/C19H26ClN3O3S.2C19H28ClN3O3S.C18H27ClN4O3S.C18H26ClN3O3S/c1-19(2,13-5-7-23(8-6-13)27(25,26)15-3-4-15)18(24)16-10-14(20)9-12-11-21-22-17(12)16;1-12(2)27(25,26)23-7-5-14(6-8-23)19(3,4)18(24)16-10-15(20)9-13-11-21-22-17(13)16;1-4-9-27(25,26)23-7-5-14(6-8-23)19(2,3)18(24)16-11-15(20)10-13-12-21-22-17(13)16;1-18(2,13-5-7-23(8-6-13)27(25,26)22(3)4)17(24)15-10-14(19)9-12-11-20-21-16(12)15;1-4-26(24,25)22-7-5-13(6-8-22)18(2,3)17(23)15-10-14(19)9-12-11-20-21-16(12)15/h9-11,13,15,18,24H,3-8H2,1-2H3,(H,21,22);9-12,14,18,24H,5-8H2,1-4H3,(H,21,22);10-12,14,18,24H,4-9H2,1-3H3,(H,21,22);9-11,13,17,24H,5-8H2,1-4H3,(H,20,21);9-11,13,17,23H,4-8H2,1-3H3,(H,20,21)
• InChIKey: MLMZRLJOKKKVCQ-UHFFFAOYSA-N
• XLogP: 17.07
• TPSA: 434.69 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 20
• Rotatable Bonds: 26
• Heavy Atoms: 134
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2054.80
LogP ≤ 5	17.07
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol?

The IUPAC name of 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol (CID 159601263) is 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol.

What is the SMILES notation for 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol?

The canonical SMILES for 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol is CC(C)(C1CCN(S(=O)(=O)C2CC2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC(C)S(=O)(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1.CCCS(=O)(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1.CCS(=O)(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1.CN(C)S(=O)(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1.

What is the InChIKey of 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol?

The InChIKey is MLMZRLJOKKKVCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26ClN3O3S.2C19H28ClN3O3S.C18H27ClN4O3S.C18H26ClN3O3S/c1-19(2,13-5-7-23(8-6-13)27(25,26)15-3-4-15)18(24)16-10-14(20)9-12-11-21-22-17(12)16;1-12(2)27(25,26)23-7-5-14(6-8-23)19(3,4)18(24)16-10-15(20)9-13-11-21-22-17(13)16;1-4-9-27(25,26)23-7-5-14(6-8-23)19(2,3)18(24)16-11-15(20)10-13-12-21-22-17(13)16;1-18(2,13-5-7-23(8-6-13)27(25,26)22(3)4)17(24)15-10-14(19)9-12-11-20-21-16(12)15;1-4-26(24,25)22-7-5-13(6-8-22)18(2,3)17(23)15-10-14(19)9-12-11-20-21-16(12)15/h9-11,13,15,18,24H,3-8H2,1-2H3,(H,21,22);9-12,14,18,24H,5-8H2,1-4H3,(H,21,22);10-12,14,18,24H,4-9H2,1-3H3,(H,21,22);9-11,13,17,24H,5-8H2,1-4H3,(H,20,21);9-11,13,17,23H,4-8H2,1-3H3,(H,20,21).

What are the key properties of 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol?

1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol has a molecular weight of 2054.80 g/mol, XLogP of 17.07, 26 rotatable bonds, 10 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(5-chloro-1H-indazol-7-yl)-2-(1-cyclopropylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-(1-ethylsulfonylpiperidin-4-yl)-2-methylpropan-1-ol;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N,N-dimethylpiperidine-1-sulfonamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propan-2-ylsulfonylpiperidin-4-yl)propan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-propylsulfonylpiperidin-4-yl)propan-1-ol is sourced from PubChem (CID 159601263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).