N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide

C84H106Cl4F2N16O8 — CID 158244412

IUPACN-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide
SMILESCC(C)(C1CCN(C(=O)NCCN2CCOCC2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)NCc2ccccc2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CC1(F)CC(C)(C(O)c2cc(Cl)c(F)c3cn[nH]c23)C1.Cc1ccc(NC(=O)N2CCC(C(C)(C)[C@H](O)c3cc(Cl)cc4cn[nH]c34)CC2)nc1
InChIInChI=1S/C24H29ClN4O2.C23H34ClN5O3.C23H28ClN5O2.C14H15ClF2N2O/c1-24(2,22(30)20-13-19(25)12-17-15-27-28-21(17)20)18-8-10-29(11-9-18)23(31)26-14-16-6-4-3-5-7-16;1-23(2,21(30)19-14-18(24)13-16-15-26-27-20(16)19)17-3-6-29(7-4-17)22(31)25-5-8-28-9-11-32-12-10-28;1-14-4-5-19(25-12-14)27-22(31)29-8-6-16(7-9-29)23(2,3)21(30)18-11-17(24)10-15-13-26-28-20(15)18;1-13(5-14(2,17)6-13)12(20)7-3-9(15)10(16)8-4-18-19-11(7)8/h3-7,12-13,15,18,22,30H,8-11,14H2,1-2H3,(H,26,31)(H,27,28);13-15,17,21,30H,3-12H2,1-2H3,(H,25,31)(H,26,27);4-5,10-13,16,21,30H,6-9H2,1-3H3,(H,26,28)(H,25,27,31);3-4,12,20H,5-6H2,1-2H3,(H,18,19)/t22-;2*21-;/m111./s1
InChIKeyGFYFFDZZDOJBMY-PHCGMPIXSA-N
MW1647.68 g/mol
LogP16.77
Rot. Bonds17

About N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide

N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide (PubChem CID 158244412) has the molecular formula C84H106Cl4F2N16O8 and a molecular weight of 1647.68 g/mol. Its IUPAC name is N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide
PubChem CID158244412
Molecular FormulaC84H106Cl4F2N16O8
Molecular Weight1647.68 g/mol
Exact Mass1644.71
IUPAC NameN-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide
SMILESCC(C)(C1CCN(C(=O)NCCN2CCOCC2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)NCc2ccccc2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CC1(F)CC(C)(C(O)c2cc(Cl)c(F)c3cn[nH]c23)C1.Cc1ccc(NC(=O)N2CCC(C(C)(C)[C@H](O)c3cc(Cl)cc4cn[nH]c34)CC2)nc1
InChIInChI=1S/C24H29ClN4O2.C23H34ClN5O3.C23H28ClN5O2.C14H15ClF2N2O/c1-24(2,22(30)20-13-19(25)12-17-15-27-28-21(17)20)18-8-10-29(11-9-18)23(31)26-14-16-6-4-3-5-7-16;1-23(2,21(30)19-14-18(24)13-16-15-26-27-20(16)19)17-3-6-29(7-4-17)22(31)25-5-8-28-9-11-32-12-10-28;1-14-4-5-19(25-12-14)27-22(31)29-8-6-16(7-9-29)23(2,3)21(30)18-11-17(24)10-15-13-26-28-20(15)18;1-13(5-14(2,17)6-13)12(20)7-3-9(15)10(16)8-4-18-19-11(7)8/h3-7,12-13,15,18,22,30H,8-11,14H2,1-2H3,(H,26,31)(H,27,28);13-15,17,21,30H,3-12H2,1-2H3,(H,25,31)(H,26,27);4-5,10-13,16,21,30H,6-9H2,1-3H3,(H,26,28)(H,25,27,31);3-4,12,20H,5-6H2,1-2H3,(H,18,19)/t22-;2*21-;/m111./s1
InChIKeyGFYFFDZZDOJBMY-PHCGMPIXSA-N
XLogP16.77
TPSA318.02 Ų
H-Bond Donors11
H-Bond Acceptors14
Rotatable Bonds17
Heavy Atoms114
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001647.68
LogP ≤ 516.77
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1014

Analyze N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide?
The IUPAC name of N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide (CID 158244412) is N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide?
The canonical SMILES for N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide is CC(C)(C1CCN(C(=O)NCCN2CCOCC2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)NCc2ccccc2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CC1(F)CC(C)(C(O)c2cc(Cl)c(F)c3cn[nH]c23)C1.Cc1ccc(NC(=O)N2CCC(C(C)(C)[C@H](O)c3cc(Cl)cc4cn[nH]c34)CC2)nc1.
What is the InChIKey of N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide?
The InChIKey is GFYFFDZZDOJBMY-PHCGMPIXSA-N. The full InChI is InChI=1S/C24H29ClN4O2.C23H34ClN5O3.C23H28ClN5O2.C14H15ClF2N2O/c1-24(2,22(30)20-13-19(25)12-17-15-27-28-21(17)20)18-8-10-29(11-9-18)23(31)26-14-16-6-4-3-5-7-16;1-23(2,21(30)19-14-18(24)13-16-15-26-27-20(16)19)17-3-6-29(7-4-17)22(31)25-5-8-28-9-11-32-12-10-28;1-14-4-5-19(25-12-14)27-22(31)29-8-6-16(7-9-29)23(2,3)21(30)18-11-17(24)10-15-13-26-28-20(15)18;1-13(5-14(2,17)6-13)12(20)7-3-9(15)10(16)8-4-18-19-11(7)8/h3-7,12-13,15,18,22,30H,8-11,14H2,1-2H3,(H,26,31)(H,27,28);13-15,17,21,30H,3-12H2,1-2H3,(H,25,31)(H,26,27);4-5,10-13,16,21,30H,6-9H2,1-3H3,(H,26,28)(H,25,27,31);3-4,12,20H,5-6H2,1-2H3,(H,18,19)/t22-;2*21-;/m111./s1.
What are the key properties of N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide?
N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide has a molecular weight of 1647.68 g/mol, XLogP of 16.77, 17 rotatable bonds, 11 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidine-1-carboxamide;(5-chloro-4-fluoro-1H-indazol-7-yl)-(3-fluoro-1,3-dimethylcyclobutyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide is sourced from PubChem (CID 158244412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).