1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride

C119H104Cl3F10N21O5S — CID 162239262

About 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride

1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride (PubChem CID 162239262) has the molecular formula C119H104Cl3F10N21O5S and a molecular weight of 2236.69 g/mol. Its IUPAC name is 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride.

Molecular Properties

• Compound Name: 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride
• PubChem CID: 162239262
• Molecular Formula: C119H104Cl3F10N21O5S
• Molecular Weight: 2236.69 g/mol
• Exact Mass: 2233.72
• IUPAC Name: 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride
• SMILES: CC1=C(c2ccc(CC(=O)c3c(F)cc(F)cc3F)cc2)CN(c2ncccc2F)CC1.CC1=C(c2ccc(CC(=O)c3ccccc3Cl)cc2)CN(c2nnn(C)n2)CC1.CC1=C(c2cnc(CC(=O)c3cc(F)ccc3C)cn2)CN(c2ncccc2F)CC1.CC1=C(c2cnc(CC(=O)c3cc(F)ccc3Cl)cn2)CN(c2ncccc2F)CC1.CC1=C(c2cnc(NC(=O)c3c(F)cccc3F)cn2)CN(c2nc(-c3cccnc3)cs2)CC1.Cl
• InChI: InChI=1S/C25H20F4N2O.C25H20F2N6OS.C24H22F2N4O.C23H19ClF2N4O.C22H22ClN5O.ClH/c1-15-8-10-31(25-20(27)3-2-9-30-25)14-19(15)17-6-4-16(5-7-17)11-23(32)24-21(28)12-18(26)13-22(24)29;1-15-7-9-33(25-31-21(14-35-25)16-4-3-8-28-10-16)13-17(15)20-11-30-22(12-29-20)32-24(34)23-18(26)5-2-6-19(23)27;1-15-5-6-17(25)10-19(15)23(31)11-18-12-29-22(13-28-18)20-14-30(9-7-16(20)2)24-21(26)4-3-8-27-24;1-14-6-8-30(23-20(26)3-2-7-27-23)13-18(14)21-12-28-16(11-29-21)10-22(31)17-9-15(25)4-5-19(17)24;1-15-11-12-28(22-24-26-27(2)25-22)14-19(15)17-9-7-16(8-10-17)13-21(29)18-5-3-4-6-20(18)23;/h2-7,9,12-13H,8,10-11,14H2,1H3;2-6,8,10-12,14H,7,9,13H2,1H3,(H,30,32,34);3-6,8,10,12-13H,7,9,11,14H2,1-2H3;2-5,7,9,11-12H,6,8,10,13H2,1H3;3-10H,11-14H2,1-2H3;1H
• InChIKey: UZZDLHDWFPGNQH-UHFFFAOYSA-N
• XLogP: 24.83
• TPSA: 298.97 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 26
• Rotatable Bonds: 25
• Heavy Atoms: 159
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2236.69
LogP ≤ 5	24.83
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride?

The IUPAC name of 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride (CID 162239262) is 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride.

What is the SMILES notation for 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride?

The canonical SMILES for 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride is CC1=C(c2ccc(CC(=O)c3c(F)cc(F)cc3F)cc2)CN(c2ncccc2F)CC1.CC1=C(c2ccc(CC(=O)c3ccccc3Cl)cc2)CN(c2nnn(C)n2)CC1.CC1=C(c2cnc(CC(=O)c3cc(F)ccc3C)cn2)CN(c2ncccc2F)CC1.CC1=C(c2cnc(CC(=O)c3cc(F)ccc3Cl)cn2)CN(c2ncccc2F)CC1.CC1=C(c2cnc(NC(=O)c3c(F)cccc3F)cn2)CN(c2nc(-c3cccnc3)cs2)CC1.Cl.

What is the InChIKey of 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride?

The InChIKey is UZZDLHDWFPGNQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20F4N2O.C25H20F2N6OS.C24H22F2N4O.C23H19ClF2N4O.C22H22ClN5O.ClH/c1-15-8-10-31(25-20(27)3-2-9-30-25)14-19(15)17-6-4-16(5-7-17)11-23(32)24-21(28)12-18(26)13-22(24)29;1-15-7-9-33(25-31-21(14-35-25)16-4-3-8-28-10-16)13-17(15)20-11-30-22(12-29-20)32-24(34)23-18(26)5-2-6-19(23)27;1-15-5-6-17(25)10-19(15)23(31)11-18-12-29-22(13-28-18)20-14-30(9-7-16(20)2)24-21(26)4-3-8-27-24;1-14-6-8-30(23-20(26)3-2-7-27-23)13-18(14)21-12-28-16(11-29-21)10-22(31)17-9-15(25)4-5-19(17)24;1-15-11-12-28(22-24-26-27(2)25-22)14-19(15)17-9-7-16(8-10-17)13-21(29)18-5-3-4-6-20(18)23;/h2-7,9,12-13H,8,10-11,14H2,1H3;2-6,8,10-12,14H,7,9,13H2,1H3,(H,30,32,34);3-6,8,10,12-13H,7,9,11,14H2,1-2H3;2-5,7,9,11-12H,6,8,10,13H2,1H3;3-10H,11-14H2,1-2H3;1H.

What are the key properties of 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride?

1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride has a molecular weight of 2236.69 g/mol, XLogP of 24.83, 25 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(2-chloro-5-fluorophenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;1-(2-chlorophenyl)-2-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;2,6-difluoro-N-[5-[4-methyl-1-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;1-(5-fluoro-2-methylphenyl)-2-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]ethanone;2-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(2,4,6-trifluorophenyl)ethanone;hydrochloride is sourced from PubChem (CID 162239262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).