4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide

C91H118Cl4FN17O8 — CID 161429066

About 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide

4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide (PubChem CID 161429066) has the molecular formula C91H118Cl4FN17O8 and a molecular weight of 1738.87 g/mol. Its IUPAC name is 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide.

Molecular Properties

• Compound Name: 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide
• PubChem CID: 161429066
• Molecular Formula: C91H118Cl4FN17O8
• Molecular Weight: 1738.87 g/mol
• Exact Mass: 1735.81
• IUPAC Name: 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide
• SMILES: C#CCNC(=O)N1CCC(C(C)(C)[C@H](O)c2cc(Cl)cc3cn[nH]c23)CC1.C#Cc1ccc(CNC(=O)N2CCC(C(C)(C)[C@H](O)c3cc(Cl)cc4cn[nH]c34)CC2)cn1.CC(C)(C1CCN(C(=O)NC2CCCC2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CC1(F)CCC(NC(=O)N2CCC(C(C)(C)[C@H](O)c3cc(Cl)cc4cn[nH]c34)CC2)CC1
• InChI: InChI=1S/C25H28ClN5O2.C24H34ClFN4O2.C22H31ClN4O2.C20H25ClN4O2/c1-4-20-6-5-16(13-27-20)14-28-24(33)31-9-7-18(8-10-31)25(2,3)23(32)21-12-19(26)11-17-15-29-30-22(17)21;1-23(2,21(31)19-13-17(25)12-15-14-27-29-20(15)19)16-6-10-30(11-7-16)22(32)28-18-4-8-24(3,26)9-5-18;1-22(2,20(28)18-12-16(23)11-14-13-24-26-19(14)18)15-7-9-27(10-8-15)21(29)25-17-5-3-4-6-17;1-4-7-22-19(27)25-8-5-14(6-9-25)20(2,3)18(26)16-11-15(21)10-13-12-23-24-17(13)16/h1,5-6,11-13,15,18,23,32H,7-10,14H2,2-3H3,(H,28,33)(H,29,30);12-14,16,18,21,31H,4-11H2,1-3H3,(H,27,29)(H,28,32);11-13,15,17,20,28H,3-10H2,1-2H3,(H,24,26)(H,25,29);1,10-12,14,18,26H,5-9H2,2-3H3,(H,22,27)(H,23,24)/t23-;18?,21-,24?;20-;18-/m1111/s1
• InChIKey: VXTNOHKXTBVGKR-XOMADPCASA-N
• XLogP: 17.61
• TPSA: 337.89 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 13
• Rotatable Bonds: 17
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1738.87
LogP ≤ 5	17.61
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide?

The IUPAC name of 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide (CID 161429066) is 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide.

What is the SMILES notation for 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide?

The canonical SMILES for 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide is C#CCNC(=O)N1CCC(C(C)(C)[C@H](O)c2cc(Cl)cc3cn[nH]c23)CC1.C#Cc1ccc(CNC(=O)N2CCC(C(C)(C)[C@H](O)c3cc(Cl)cc4cn[nH]c34)CC2)cn1.CC(C)(C1CCN(C(=O)NC2CCCC2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CC1(F)CCC(NC(=O)N2CCC(C(C)(C)[C@H](O)c3cc(Cl)cc4cn[nH]c34)CC2)CC1.

What is the InChIKey of 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide?

The InChIKey is VXTNOHKXTBVGKR-XOMADPCASA-N. The full InChI is InChI=1S/C25H28ClN5O2.C24H34ClFN4O2.C22H31ClN4O2.C20H25ClN4O2/c1-4-20-6-5-16(13-27-20)14-28-24(33)31-9-7-18(8-10-31)25(2,3)23(32)21-12-19(26)11-17-15-29-30-22(17)21;1-23(2,21(31)19-13-17(25)12-15-14-27-29-20(15)19)16-6-10-30(11-7-16)22(32)28-18-4-8-24(3,26)9-5-18;1-22(2,20(28)18-12-16(23)11-14-13-24-26-19(14)18)15-7-9-27(10-8-15)21(29)25-17-5-3-4-6-17;1-4-7-22-19(27)25-8-5-14(6-9-25)20(2,3)18(26)16-11-15(21)10-13-12-23-24-17(13)16/h1,5-6,11-13,15,18,23,32H,7-10,14H2,2-3H3,(H,28,33)(H,29,30);12-14,16,18,21,31H,4-11H2,1-3H3,(H,27,29)(H,28,32);11-13,15,17,20,28H,3-10H2,1-2H3,(H,24,26)(H,25,29);1,10-12,14,18,26H,5-9H2,2-3H3,(H,22,27)(H,23,24)/t23-;18?,21-,24?;20-;18-/m1111/s1.

What are the key properties of 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide?

4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide has a molecular weight of 1738.87 g/mol, XLogP of 17.61, 17 rotatable bonds, 12 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopentylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(6-ethynyl-3-pyridinyl)methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-fluoro-4-methylcyclohexyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide is sourced from PubChem (CID 161429066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).