2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride

C115H100Cl3F10N25O5S — CID 161331789

About 2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride

2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride (PubChem CID 161331789) has the molecular formula C115H100Cl3F10N25O5S and a molecular weight of 2240.64 g/mol. Its IUPAC name is 2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride.

Molecular Properties

• Compound Name: 2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride
• PubChem CID: 161331789
• Molecular Formula: C115H100Cl3F10N25O5S
• Molecular Weight: 2240.64 g/mol
• Exact Mass: 2237.70
• IUPAC Name: 2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride
• SMILES: CC1=C(c2ccc(NC(=O)c3c(F)cc(F)cc3F)cc2)CN(c2ncccc2F)CC1.CC1=C(c2ccc(NC(=O)c3ccccc3Cl)cc2)CN(c2nnn(C)n2)CC1.CC1=C(c2cnc(NC(=O)c3c(F)cccc3F)cn2)CN(c2nc(-c3cccnc3)cs2)CC1.CC1=C(c2cnc(NC(=O)c3cc(F)ccc3C)cn2)CN(c2ncccc2F)CC1.CC1=C(c2cnc(NC(=O)c3cc(F)ccc3Cl)cn2)CN(c2ncccc2F)CC1.Cl
• InChI: InChI=1S/C25H20F2N6OS.C24H19F4N3O.C23H21F2N5O.C22H18ClF2N5O.C21H21ClN6O.ClH/c1-15-7-9-33(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;1-14-8-10-31(23-19(26)3-2-9-29-23)13-18(14)15-4-6-17(7-5-15)30-24(32)22-20(27)11-16(25)12-21(22)28;1-14-5-6-16(24)10-17(14)23(31)29-21-12-27-20(11-28-21)18-13-30(9-7-15(18)2)22-19(25)4-3-8-26-22;1-13-6-8-30(21-18(25)3-2-7-26-21)12-16(13)19-10-28-20(11-27-19)29-22(31)15-9-14(24)4-5-17(15)23;1-14-11-12-28(21-24-26-27(2)25-21)13-18(14)15-7-9-16(10-8-15)23-20(29)17-5-3-4-6-19(17)22;/h2-6,8,10-12,14H,7,9,13H2,1H3,(H,30,32,34);2-7,9,11-12H,8,10,13H2,1H3,(H,30,32);3-6,8,10-12H,7,9,13H2,1-2H3,(H,28,29,31);2-5,7,9-11H,6,8,12H2,1H3,(H,28,29,31);3-10H,11-13H2,1-2H3,(H,23,29);1H
• InChIKey: DIRAWUYVFSYELL-UHFFFAOYSA-N
• XLogP: 24.14
• TPSA: 347.09 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 26
• Rotatable Bonds: 21
• Heavy Atoms: 159
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2240.64
LogP ≤ 5	24.14
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride?

The IUPAC name of 2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride (CID 161331789) is 2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride.

What is the SMILES notation for 2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride?

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

What is the InChIKey of 2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride?

The InChIKey is DIRAWUYVFSYELL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20F2N6OS.C24H19F4N3O.C23H21F2N5O.C22H18ClF2N5O.C21H21ClN6O.ClH/c1-15-7-9-33(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;1-14-8-10-31(23-19(26)3-2-9-29-23)13-18(14)15-4-6-17(7-5-15)30-24(32)22-20(27)11-16(25)12-21(22)28;1-14-5-6-16(24)10-17(14)23(31)29-21-12-27-20(11-28-21)18-13-30(9-7-15(18)2)22-19(25)4-3-8-26-22;1-13-6-8-30(21-18(25)3-2-7-26-21)12-16(13)19-10-28-20(11-27-19)29-22(31)15-9-14(24)4-5-17(15)23;1-14-11-12-28(21-24-26-27(2)25-21)13-18(14)15-7-9-16(10-8-15)23-20(29)17-5-3-4-6-19(17)22;/h2-6,8,10-12,14H,7,9,13H2,1H3,(H,30,32,34);2-7,9,11-12H,8,10,13H2,1H3,(H,30,32);3-6,8,10-12H,7,9,13H2,1-2H3,(H,28,29,31);2-5,7,9-11H,6,8,12H2,1H3,(H,28,29,31);3-10H,11-13H2,1-2H3,(H,23,29);1H.

What are the key properties of 2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride?

2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride has a molecular weight of 2240.64 g/mol, XLogP of 24.14, 21 rotatable bonds, 5 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;2-chloro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;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;5-fluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]-2-methylbenzamide;2,4,6-trifluoro-N-[4-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;hydrochloride is sourced from PubChem (CID 161331789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).