4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone

C117H133Cl5F3N21O10 — CID 162170497

IUPAC4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone
SMILESCC(C)(C1CCN(C(=O)Nc2cccc(C#N)c2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)Nc2cccc(F)c2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)c2cccnc2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC(F)(F)c1ccc(C(=O)N2CCC(C(C)(C)C(O)c3cc(Cl)cc4cn[nH]c34)CC2)cn1.Cc1ccc(NC(=O)N2CCC(C(C)(C)C(O)c3cc(Cl)cc4cn[nH]c34)CC2)cc1
InChIInChI=1S/C24H27ClF2N4O2.C24H26ClN5O2.C24H29ClN4O2.C23H26ClFN4O2.C22H25ClN4O2/c1-23(2,21(32)18-11-17(25)10-15-13-29-30-20(15)18)16-6-8-31(9-7-16)22(33)14-4-5-19(28-12-14)24(3,26)27;1-24(2,22(31)20-12-18(25)11-16-14-27-29-21(16)20)17-6-8-30(9-7-17)23(32)28-19-5-3-4-15(10-19)13-26;1-15-4-6-19(7-5-15)27-23(31)29-10-8-17(9-11-29)24(2,3)22(30)20-13-18(25)12-16-14-26-28-21(16)20;1-23(2,21(30)19-11-16(24)10-14-13-26-28-20(14)19)15-6-8-29(9-7-15)22(31)27-18-5-3-4-17(25)12-18;1-22(2,20(28)18-11-17(23)10-15-13-25-26-19(15)18)16-5-8-27(9-6-16)21(29)14-4-3-7-24-12-14/h4-5,10-13,16,21,32H,6-9H2,1-3H3,(H,29,30);3-5,10-12,14,17,22,31H,6-9H2,1-2H3,(H,27,29)(H,28,32);4-7,12-14,17,22,30H,8-11H2,1-3H3,(H,26,28)(H,27,31);3-5,10-13,15,21,30H,6-9H2,1-2H3,(H,26,28)(H,27,31);3-4,7,10-13,16,20,28H,5-6,8-9H2,1-2H3,(H,25,26)
InChIKeyZNSKIYXAAIFDBJ-UHFFFAOYSA-N
MW2227.75 g/mol
LogP25.54
Rot. Bonds21

About 4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone

4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone (PubChem CID 162170497) has the molecular formula C117H133Cl5F3N21O10 and a molecular weight of 2227.75 g/mol. Its IUPAC name is 4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone.

Molecular Properties

Compound Name4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone
PubChem CID162170497
Molecular FormulaC117H133Cl5F3N21O10
Molecular Weight2227.75 g/mol
Exact Mass2223.89
IUPAC Name4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone
SMILESCC(C)(C1CCN(C(=O)Nc2cccc(C#N)c2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)Nc2cccc(F)c2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)c2cccnc2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC(F)(F)c1ccc(C(=O)N2CCC(C(C)(C)C(O)c3cc(Cl)cc4cn[nH]c34)CC2)cn1.Cc1ccc(NC(=O)N2CCC(C(C)(C)C(O)c3cc(Cl)cc4cn[nH]c34)CC2)cc1
InChIInChI=1S/C24H27ClF2N4O2.C24H26ClN5O2.C24H29ClN4O2.C23H26ClFN4O2.C22H25ClN4O2/c1-23(2,21(32)18-11-17(25)10-15-13-29-30-20(15)18)16-6-8-31(9-7-16)22(33)14-4-5-19(28-12-14)24(3,26)27;1-24(2,22(31)20-12-18(25)11-16-14-27-29-21(16)20)17-6-8-30(9-7-17)23(32)28-19-5-3-4-15(10-19)13-26;1-15-4-6-19(7-5-15)27-23(31)29-10-8-17(9-11-29)24(2,3)22(30)20-13-18(25)12-16-14-26-28-21(16)20;1-23(2,21(30)19-11-16(24)10-14-13-26-28-20(14)19)15-6-8-29(9-7-15)22(31)27-18-5-3-4-17(25)12-18;1-22(2,20(28)18-11-17(23)10-15-13-25-26-19(15)18)16-5-8-27(9-6-16)21(29)14-4-3-7-24-12-14/h4-5,10-13,16,21,32H,6-9H2,1-3H3,(H,29,30);3-5,10-12,14,17,22,31H,6-9H2,1-2H3,(H,27,29)(H,28,32);4-7,12-14,17,22,30H,8-11H2,1-3H3,(H,26,28)(H,27,31);3-5,10-13,15,21,30H,6-9H2,1-2H3,(H,26,28)(H,27,31);3-4,7,10-13,16,20,28H,5-6,8-9H2,1-2H3,(H,25,26)
InChIKeyZNSKIYXAAIFDBJ-UHFFFAOYSA-N
XLogP25.54
TPSA431.76 Ų
H-Bond Donors13
H-Bond Acceptors18
Rotatable Bonds21
Heavy Atoms156
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002227.75
LogP ≤ 525.54
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1018

Analyze 4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone?
The IUPAC name of 4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone (CID 162170497) is 4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone.
What is the SMILES notation for 4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone?
The canonical SMILES for 4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone is CC(C)(C1CCN(C(=O)Nc2cccc(C#N)c2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)Nc2cccc(F)c2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)c2cccnc2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC(F)(F)c1ccc(C(=O)N2CCC(C(C)(C)C(O)c3cc(Cl)cc4cn[nH]c34)CC2)cn1.Cc1ccc(NC(=O)N2CCC(C(C)(C)C(O)c3cc(Cl)cc4cn[nH]c34)CC2)cc1.
What is the InChIKey of 4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone?
The InChIKey is ZNSKIYXAAIFDBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27ClF2N4O2.C24H26ClN5O2.C24H29ClN4O2.C23H26ClFN4O2.C22H25ClN4O2/c1-23(2,21(32)18-11-17(25)10-15-13-29-30-20(15)18)16-6-8-31(9-7-16)22(33)14-4-5-19(28-12-14)24(3,26)27;1-24(2,22(31)20-12-18(25)11-16-14-27-29-21(16)20)17-6-8-30(9-7-17)23(32)28-19-5-3-4-15(10-19)13-26;1-15-4-6-19(7-5-15)27-23(31)29-10-8-17(9-11-29)24(2,3)22(30)20-13-18(25)12-16-14-26-28-21(16)20;1-23(2,21(30)19-11-16(24)10-14-13-26-28-20(14)19)15-6-8-29(9-7-15)22(31)27-18-5-3-4-17(25)12-18;1-22(2,20(28)18-11-17(23)10-15-13-25-26-19(15)18)16-5-8-27(9-6-16)21(29)14-4-3-7-24-12-14/h4-5,10-13,16,21,32H,6-9H2,1-3H3,(H,29,30);3-5,10-12,14,17,22,31H,6-9H2,1-2H3,(H,27,29)(H,28,32);4-7,12-14,17,22,30H,8-11H2,1-3H3,(H,26,28)(H,27,31);3-5,10-13,15,21,30H,6-9H2,1-2H3,(H,26,28)(H,27,31);3-4,7,10-13,16,20,28H,5-6,8-9H2,1-2H3,(H,25,26).
What are the key properties of 4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone?
4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone has a molecular weight of 2227.75 g/mol, XLogP of 25.54, 21 rotatable bonds, 13 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-fluorophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-[6-(1,1-difluoroethyl)-3-pyridinyl]methanone;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-pyridin-3-ylmethanone is sourced from PubChem (CID 162170497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).