methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine

C71H73F9N10O4S2 — CID 159533074

About methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine

methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine (PubChem CID 159533074) has the molecular formula C71H73F9N10O4S2 and a molecular weight of 1365.55 g/mol. Its IUPAC name is methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine.

Molecular Properties

• Compound Name: methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine
• PubChem CID: 159533074
• Molecular Formula: C71H73F9N10O4S2
• Molecular Weight: 1365.55 g/mol
• Exact Mass: 1364.51
• IUPAC Name: methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine
• SMILES: C.C.C.C.Cc1ccc(S(=O)(=O)N2CC=C(c3ncc(-c4cccc(C(F)(F)F)c4)[nH]3)CC2)cc1.FC(F)(F)c1cccc(-c2cnc(C3=CCN(c4ccccn4)CC3)[nH]2)c1.O=S(=O)(c1cccc2ccccc12)N1CC=C(c2ncc(-c3cccc(C(F)(F)F)c3)[nH]2)CC1
• InChI: InChI=1S/C25H20F3N3O2S.C22H20F3N3O2S.C20H17F3N4.4CH4/c26-25(27,28)20-8-3-7-19(15-20)22-16-29-24(30-22)18-11-13-31(14-12-18)34(32,33)23-10-4-6-17-5-1-2-9-21(17)23;1-15-5-7-19(8-6-15)31(29,30)28-11-9-16(10-12-28)21-26-14-20(27-21)17-3-2-4-18(13-17)22(23,24)25;21-20(22,23)16-5-3-4-15(12-16)17-13-25-19(26-17)14-7-10-27(11-8-14)18-6-1-2-9-24-18;;;;/h1-11,15-16H,12-14H2,(H,29,30);2-9,13-14H,10-12H2,1H3,(H,26,27);1-7,9,12-13H,8,10-11H2,(H,25,26);4*1H4
• InChIKey: MDFZPXPVMPPOBN-UHFFFAOYSA-N
• XLogP: 17.94
• TPSA: 176.93 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 9
• Rotatable Bonds: 11
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1365.55
LogP ≤ 5	17.94
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine?

The IUPAC name of methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine (CID 159533074) is methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine.

What is the SMILES notation for methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine?

The canonical SMILES for methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine is C.C.C.C.Cc1ccc(S(=O)(=O)N2CC=C(c3ncc(-c4cccc(C(F)(F)F)c4)[nH]3)CC2)cc1.FC(F)(F)c1cccc(-c2cnc(C3=CCN(c4ccccn4)CC3)[nH]2)c1.O=S(=O)(c1cccc2ccccc12)N1CC=C(c2ncc(-c3cccc(C(F)(F)F)c3)[nH]2)CC1.

What is the InChIKey of methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine?

The InChIKey is MDFZPXPVMPPOBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20F3N3O2S.C22H20F3N3O2S.C20H17F3N4.4CH4/c26-25(27,28)20-8-3-7-19(15-20)22-16-29-24(30-22)18-11-13-31(14-12-18)34(32,33)23-10-4-6-17-5-1-2-9-21(17)23;1-15-5-7-19(8-6-15)31(29,30)28-11-9-16(10-12-28)21-26-14-20(27-21)17-3-2-4-18(13-17)22(23,24)25;21-20(22,23)16-5-3-4-15(12-16)17-13-25-19(26-17)14-7-10-27(11-8-14)18-6-1-2-9-24-18;;;;/h1-11,15-16H,12-14H2,(H,29,30);2-9,13-14H,10-12H2,1H3,(H,26,27);1-7,9,12-13H,8,10-11H2,(H,25,26);4*1H4.

What are the key properties of methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine?

methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine has a molecular weight of 1365.55 g/mol, XLogP of 17.94, 11 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for methane;1-(4-methylphenyl)sulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;1-naphthalen-1-ylsulfonyl-4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridine;2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine is sourced from PubChem (CID 159533074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).