N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one

C128H83Cl3F41N7O8 — CID 159559373

About N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one

N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one (PubChem CID 159559373) has the molecular formula C128H83Cl3F41N7O8 and a molecular weight of 2732.39 g/mol. Its IUPAC name is N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one.

Molecular Properties

• Compound Name: N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one
• PubChem CID: 159559373
• Molecular Formula: C128H83Cl3F41N7O8
• Molecular Weight: 2732.39 g/mol
• Exact Mass: 2729.47
• IUPAC Name: N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one
• SMILES: Cc1ccc(C(=O)CC(Cc2ccc(F)c(F)c2)(c2cc(F)cc(OC(F)(F)C(F)F)c2)c2ccc(Cc3ccc(F)c(F)c3)cn2)cc1C(F)(F)F.Cc1ccc(C[C@@](NC(=O)c2ccc(F)c(C(F)(F)F)c2)(c2cc(F)cc(OC(F)(F)C(F)F)c2)c2ccc(Cl)cn2)cc1F.Cc1ccc(C[C@](NC(=O)c2ccc(F)c(C(F)(F)F)c2)(c2cc(F)cc(OC(F)(F)C(F)F)c2)c2ccc(Cl)cn2)cc1.Cc1ccc(C[C@](NC(=O)c2ccc(F)c(C(F)(F)F)c2)(c2cc(F)cc(OC(F)(F)C(F)F)c2)c2ccc(Cl)cn2)cc1F
• InChI: InChI=1S/C38H25F12NO2.2C30H19ClF10N2O2.C30H20ClF9N2O2/c1-20-2-6-24(13-28(20)37(46,47)48)33(52)18-36(17-22-4-8-30(41)32(43)12-22,25-14-26(39)16-27(15-25)53-38(49,50)35(44)45)34-9-5-23(19-51-34)10-21-3-7-29(40)31(42)11-21;2*1-15-2-3-16(8-24(15)34)13-28(25-7-5-19(31)14-42-25,18-10-20(32)12-21(11-18)45-30(40,41)27(35)36)43-26(44)17-4-6-23(33)22(9-17)29(37,38)39;1-16-2-4-17(5-3-16)14-28(25-9-7-20(31)15-41-25,19-11-21(32)13-22(12-19)44-30(39,40)27(34)35)42-26(43)18-6-8-24(33)23(10-18)29(36,37)38/h2-9,11-16,19,35H,10,17-18H2,1H3;2*2-12,14,27H,13H2,1H3,(H,43,44);2-13,15,27H,14H2,1H3,(H,42,43)/t;3*28-/m.100/s1
• InChIKey: MGKDXURVFPAZGY-WLPHSMFNSA-N
• XLogP: 36.49
• TPSA: 192.85 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 12
• Rotatable Bonds: 39
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2732.39
LogP ≤ 5	36.49
H-Bond Donors ≤ 5	3
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 N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one?

The IUPAC name of N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one (CID 159559373) is N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one.

What is the SMILES notation for N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one?

The canonical SMILES for N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one is Cc1ccc(C(=O)CC(Cc2ccc(F)c(F)c2)(c2cc(F)cc(OC(F)(F)C(F)F)c2)c2ccc(Cc3ccc(F)c(F)c3)cn2)cc1C(F)(F)F.Cc1ccc(C[C@@](NC(=O)c2ccc(F)c(C(F)(F)F)c2)(c2cc(F)cc(OC(F)(F)C(F)F)c2)c2ccc(Cl)cn2)cc1F.Cc1ccc(C[C@](NC(=O)c2ccc(F)c(C(F)(F)F)c2)(c2cc(F)cc(OC(F)(F)C(F)F)c2)c2ccc(Cl)cn2)cc1.Cc1ccc(C[C@](NC(=O)c2ccc(F)c(C(F)(F)F)c2)(c2cc(F)cc(OC(F)(F)C(F)F)c2)c2ccc(Cl)cn2)cc1F.

What is the InChIKey of N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one?

The InChIKey is MGKDXURVFPAZGY-WLPHSMFNSA-N. The full InChI is InChI=1S/C38H25F12NO2.2C30H19ClF10N2O2.C30H20ClF9N2O2/c1-20-2-6-24(13-28(20)37(46,47)48)33(52)18-36(17-22-4-8-30(41)32(43)12-22,25-14-26(39)16-27(15-25)53-38(49,50)35(44)45)34-9-5-23(19-51-34)10-21-3-7-29(40)31(42)11-21;2*1-15-2-3-16(8-24(15)34)13-28(25-7-5-19(31)14-42-25,18-10-20(32)12-21(11-18)45-30(40,41)27(35)36)43-26(44)17-4-6-23(33)22(9-17)29(37,38)39;1-16-2-4-17(5-3-16)14-28(25-9-7-20(31)15-41-25,19-11-21(32)13-22(12-19)44-30(39,40)27(34)35)42-26(43)18-6-8-24(33)23(10-18)29(36,37)38/h2-9,11-16,19,35H,10,17-18H2,1H3;2*2-12,14,27H,13H2,1H3,(H,43,44);2-13,15,27H,14H2,1H3,(H,42,43)/t;3*28-/m.100/s1.

What are the key properties of N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one?

N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one has a molecular weight of 2732.39 g/mol, XLogP of 36.49, 39 rotatable bonds, 3 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;4-(3,4-difluorophenyl)-3-[5-[(3,4-difluorophenyl)methyl]-2-pyridinyl]-3-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-[4-methyl-3-(trifluoromethyl)phenyl]butan-1-one is sourced from PubChem (CID 159559373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).