potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium

C118H146ClF12K15N24O10 — CID 157102669

About potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium

potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium (PubChem CID 157102669) has the molecular formula C118H146ClF12K15N24O10 and a molecular weight of 2910.52 g/mol. Its IUPAC name is potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium.

Molecular Properties

• Compound Name: potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium
• PubChem CID: 157102669
• Molecular Formula: C118H146ClF12K15N24O10
• Molecular Weight: 2910.52 g/mol
• Exact Mass: 2906.57
• IUPAC Name: potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium
• SMILES: C.C.C.C#Cc1ccccc1C(C)C(N)=O.CC(C(N)=O)c1ccccc1C#Cc1nc(Cc2cnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2)ncc1C(F)(F)F.CC(C(N)=O)c1ccccc1CCc1nc(Cc2cnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2)ncc1C(F)(F)F.CC(C(N)=O)c1ccccc1CCc1nc(Cc2cnn(C3CCNCC3)c2)ncc1C(F)(F)F.CC(C)(C)OC(=O)N1CCC(n2cc(Cc3ncc(C(F)(F)F)c(Cl)n3)cn2)CC1.[H-].[K+].[K][K].[K][K].[K][K].[K][K].[K][K].[K][K].[K][K]
• InChI: InChI=1S/C30H37F3N6O3.C30H33F3N6O3.C25H29F3N6O.C19H23ClF3N5O2.C11H11NO.3CH4.15K.H/c2*1-19(27(34)40)23-8-6-5-7-21(23)9-10-25-24(30(31,32)33)17-35-26(37-25)15-20-16-36-39(18-20)22-11-13-38(14-12-22)28(41)42-29(2,3)4;1-16(24(29)35)20-5-3-2-4-18(20)6-7-22-21(25(26,27)28)14-31-23(33-22)12-17-13-32-34(15-17)19-8-10-30-11-9-19;1-18(2,3)30-17(29)27-6-4-13(5-7-27)28-11-12(9-25-28)8-15-24-10-14(16(20)26-15)19(21,22)23;1-3-9-6-4-5-7-10(9)8(2)11(12)13;;;;;;;;;;;;;;;;;;;/h5-8,16-19,22H,9-15H2,1-4H3,(H2,34,40);5-8,16-19,22H,11-15H2,1-4H3,(H2,34,40);2-5,13-16,19,30H,6-12H2,1H3,(H2,29,35);9-11,13H,4-8H2,1-3H3;1,4-8H,2H3,(H2,12,13);3*1H4;;;;;;;;;;;;;;;;/q;;;;;;;;;;;;;;;;;;;;;;+1;-1
• InChIKey: VXWZYGZPONZKMX-UHFFFAOYSA-N
• XLogP: 13.11
• TPSA: 447.41 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 27
• Rotatable Bonds: 26
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2910.52
LogP ≤ 5	13.11
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium?

The IUPAC name of potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium (CID 157102669) is potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium.

What is the SMILES notation for potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium?

The canonical SMILES for potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium is C.C.C.C#Cc1ccccc1C(C)C(N)=O.CC(C(N)=O)c1ccccc1C#Cc1nc(Cc2cnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2)ncc1C(F)(F)F.CC(C(N)=O)c1ccccc1CCc1nc(Cc2cnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2)ncc1C(F)(F)F.CC(C(N)=O)c1ccccc1CCc1nc(Cc2cnn(C3CCNCC3)c2)ncc1C(F)(F)F.CC(C)(C)OC(=O)N1CCC(n2cc(Cc3ncc(C(F)(F)F)c(Cl)n3)cn2)CC1.[H-].[K+].[K][K].[K][K].[K][K].[K][K].[K][K].[K][K].[K][K].

What is the InChIKey of potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium?

The InChIKey is VXWZYGZPONZKMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H37F3N6O3.C30H33F3N6O3.C25H29F3N6O.C19H23ClF3N5O2.C11H11NO.3CH4.15K.H/c2*1-19(27(34)40)23-8-6-5-7-21(23)9-10-25-24(30(31,32)33)17-35-26(37-25)15-20-16-36-39(18-20)22-11-13-38(14-12-22)28(41)42-29(2,3)4;1-16(24(29)35)20-5-3-2-4-18(20)6-7-22-21(25(26,27)28)14-31-23(33-22)12-17-13-32-34(15-17)19-8-10-30-11-9-19;1-18(2,3)30-17(29)27-6-4-13(5-7-27)28-11-12(9-25-28)8-15-24-10-14(16(20)26-15)19(21,22)23;1-3-9-6-4-5-7-10(9)8(2)11(12)13;;;;;;;;;;;;;;;;;;;/h5-8,16-19,22H,9-15H2,1-4H3,(H2,34,40);5-8,16-19,22H,11-15H2,1-4H3,(H2,34,40);2-5,13-16,19,30H,6-12H2,1H3,(H2,29,35);9-11,13H,4-8H2,1-3H3;1,4-8H,2H3,(H2,12,13);3*1H4;;;;;;;;;;;;;;;;/q;;;;;;;;;;;;;;;;;;;;;;+1;-1.

What are the key properties of potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium?

potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium has a molecular weight of 2910.52 g/mol, XLogP of 13.11, 26 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-amino-1-oxopropan-2-yl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]pyrazol-1-yl]piperidine-1-carboxylate;2-(2-ethynylphenyl)propanamide;hydride;methane;2-[2-[2-[2-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]propanamide;potassiopotassium is sourced from PubChem (CID 157102669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).