5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine

C162H208Cl15F21N8O4 — CID 158820887

About 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine

5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine (PubChem CID 158820887) has the molecular formula C162H208Cl15F21N8O4 and a molecular weight of 3262.25 g/mol. Its IUPAC name is 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine.

Molecular Properties

• Compound Name: 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine
• PubChem CID: 158820887
• Molecular Formula: C162H208Cl15F21N8O4
• Molecular Weight: 3262.25 g/mol
• Exact Mass: 3253.13
• IUPAC Name: 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine
• SMILES: CC(C)(C)C1CCN(C(c2ccccc2)c2cc(Cl)cc(Cl)c2)CC1.CC(C)(C)C1CCN(Cc2cc(Cl)cc(C(F)(F)F)c2)CC1.CC(C)(C)c1cc(Cl)cc(Cl)c1.CC(C)(C)c1cc(Cl)cc(OC(F)(F)F)c1.CC(C)(C)c1cnc(OCC(F)(F)C(F)F)c(C2CC2)c1.CC(C)(C)c1cnc(OCC(F)(F)C(F)F)c(Cl)c1.CC(C)C1CCN(Cc2cc(Cl)ccc2C(F)(F)F)CC1.CC(C)C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1.CC(C)c1cc(Cl)cc(OC(F)(F)F)c1.CC(c1ccc(Cl)cc1Cl)N1CCC(C(C)(C)C)CC1.C[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC(F)(C(C)(C)C)CC1
• InChI: InChI=1S/C22H27Cl2N.C17H24Cl2FN.C17H25Cl2N.C17H23ClF3N.C16H21ClF3N.C15H21Cl2N.C15H19F4NO.C12H14ClF4NO.C11H12ClF3O.C10H12Cl2.C10H10ClF3O/c1-22(2,3)18-9-11-25(12-10-18)21(16-7-5-4-6-8-16)17-13-19(23)15-20(24)14-17;1-12(13-9-14(18)11-15(19)10-13)21-7-5-17(20,6-8-21)16(2,3)4;1-12(15-6-5-14(18)11-16(15)19)20-9-7-13(8-10-20)17(2,3)4;1-16(2,3)13-4-6-22(7-5-13)11-12-8-14(17(19,20)21)10-15(18)9-12;1-11(2)12-5-7-21(8-6-12)10-13-9-14(17)3-4-15(13)16(18,19)20;1-11(2)13-5-7-18(8-6-13)10-12-3-4-14(16)15(17)9-12;1-14(2,3)10-6-11(9-4-5-9)12(20-7-10)21-8-15(18,19)13(16)17;1-11(2,3)7-4-8(13)9(18-5-7)19-6-12(16,17)10(14)15;1-10(2,3)7-4-8(12)6-9(5-7)16-11(13,14)15;1-10(2,3)7-4-8(11)6-9(12)5-7;1-6(2)7-3-8(11)5-9(4-7)15-10(12,13)14/h4-8,13-15,18,21H,9-12H2,1-3H3;9-12H,5-8H2,1-4H3;5-6,11-13H,7-10H2,1-4H3;8-10,13H,4-7,11H2,1-3H3;3-4,9,11-12H,5-8,10H2,1-2H3;3-4,9,11,13H,5-8,10H2,1-2H3;6-7,9,13H,4-5,8H2,1-3H3;4-5,10H,6H2,1-3H3;4-6H,1-3H3;4-6H,1-3H3;3-6H,1-2H3/t;12-;;;;;;;;;/m.0........./s1
• InChIKey: IVVVWDJHXGIUME-DUWAHGHGSA-N
• XLogP: 56.30
• TPSA: 82.14 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 27
• Heavy Atoms: 210
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3262.25
LogP ≤ 5	56.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine?

The IUPAC name of 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine (CID 158820887) is 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine.

What is the SMILES notation for 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine?

The canonical SMILES for 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine is CC(C)(C)C1CCN(C(c2ccccc2)c2cc(Cl)cc(Cl)c2)CC1.CC(C)(C)C1CCN(Cc2cc(Cl)cc(C(F)(F)F)c2)CC1.CC(C)(C)c1cc(Cl)cc(Cl)c1.CC(C)(C)c1cc(Cl)cc(OC(F)(F)F)c1.CC(C)(C)c1cnc(OCC(F)(F)C(F)F)c(C2CC2)c1.CC(C)(C)c1cnc(OCC(F)(F)C(F)F)c(Cl)c1.CC(C)C1CCN(Cc2cc(Cl)ccc2C(F)(F)F)CC1.CC(C)C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1.CC(C)c1cc(Cl)cc(OC(F)(F)F)c1.CC(c1ccc(Cl)cc1Cl)N1CCC(C(C)(C)C)CC1.C[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC(F)(C(C)(C)C)CC1.

What is the InChIKey of 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine?

The InChIKey is IVVVWDJHXGIUME-DUWAHGHGSA-N. The full InChI is InChI=1S/C22H27Cl2N.C17H24Cl2FN.C17H25Cl2N.C17H23ClF3N.C16H21ClF3N.C15H21Cl2N.C15H19F4NO.C12H14ClF4NO.C11H12ClF3O.C10H12Cl2.C10H10ClF3O/c1-22(2,3)18-9-11-25(12-10-18)21(16-7-5-4-6-8-16)17-13-19(23)15-20(24)14-17;1-12(13-9-14(18)11-15(19)10-13)21-7-5-17(20,6-8-21)16(2,3)4;1-12(15-6-5-14(18)11-16(15)19)20-9-7-13(8-10-20)17(2,3)4;1-16(2,3)13-4-6-22(7-5-13)11-12-8-14(17(19,20)21)10-15(18)9-12;1-11(2)12-5-7-21(8-6-12)10-13-9-14(17)3-4-15(13)16(18,19)20;1-11(2)13-5-7-18(8-6-13)10-12-3-4-14(16)15(17)9-12;1-14(2,3)10-6-11(9-4-5-9)12(20-7-10)21-8-15(18,19)13(16)17;1-11(2,3)7-4-8(13)9(18-5-7)19-6-12(16,17)10(14)15;1-10(2,3)7-4-8(12)6-9(5-7)16-11(13,14)15;1-10(2,3)7-4-8(11)6-9(12)5-7;1-6(2)7-3-8(11)5-9(4-7)15-10(12,13)14/h4-8,13-15,18,21H,9-12H2,1-3H3;9-12H,5-8H2,1-4H3;5-6,11-13H,7-10H2,1-4H3;8-10,13H,4-7,11H2,1-3H3;3-4,9,11-12H,5-8,10H2,1-2H3;3-4,9,11,13H,5-8,10H2,1-2H3;6-7,9,13H,4-5,8H2,1-3H3;4-5,10H,6H2,1-3H3;4-6H,1-3H3;4-6H,1-3H3;3-6H,1-2H3/t;12-;;;;;;;;;/m.0........./s1.

What are the key properties of 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine?

5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine has a molecular weight of 3262.25 g/mol, XLogP of 56.30, 27 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 5-tert-butyl-3-chloro-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3-chloro-5-(trifluoromethoxy)benzene;4-tert-butyl-1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidine;5-tert-butyl-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)pyridine;1-tert-butyl-3,5-dichlorobenzene;4-tert-butyl-1-[(1S)-1-(3,5-dichlorophenyl)ethyl]-4-fluoropiperidine;4-tert-butyl-1-[1-(2,4-dichlorophenyl)ethyl]piperidine;4-tert-butyl-1-[(3,5-dichlorophenyl)-phenylmethyl]piperidine;1-chloro-3-propan-2-yl-5-(trifluoromethoxy)benzene;1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-4-propan-2-ylpiperidine;1-[(3,4-dichlorophenyl)methyl]-4-propan-2-ylpiperidine is sourced from PubChem (CID 158820887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).