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

C104H88Cl5F10N25O5S2 — CID 159448206

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

2-chloro-3-fluoro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2-chloro-5-fluoro-N-[5-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;N-[4-[4-chloro-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;2,4,6-trifluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;hydrochloride (PubChem CID 159448206) has the molecular formula C104H88Cl5F10N25O5S2 and a molecular weight of 2199.40 g/mol. Its IUPAC name is 2-chloro-3-fluoro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2-chloro-5-fluoro-N-[5-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;N-[4-[4-chloro-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;2,4,6-trifluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;hydrochloride.

Molecular Properties

• Compound Name: 2-chloro-3-fluoro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2-chloro-5-fluoro-N-[5-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;N-[4-[4-chloro-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;2,4,6-trifluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;hydrochloride
• PubChem CID: 159448206
• Molecular Formula: C104H88Cl5F10N25O5S2
• Molecular Weight: 2199.40 g/mol
• Exact Mass: 2195.51
• IUPAC Name: 2-chloro-3-fluoro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2-chloro-5-fluoro-N-[5-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;N-[4-[4-chloro-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;2,4,6-trifluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;hydrochloride
• SMILES: CC1=C(c2ccc(NC(=O)c3cccc(F)c3Cl)cc2)CN(c2nnn(C)n2)CC1.CC1=C(c2cnc(NC(=O)c3c(F)cc(F)cc3F)cn2)CN(c2ncccc2F)CC1.CC1=C(c2cnc(NC(=O)c3cc(F)ccc3Cl)cn2)CN(c2nccs2)CC1.Cl.Cn1nnc(N2CCC(Cl)=C(c3ccc(NC(=O)c4c(F)cccc4F)cc3)C2)n1.O=C(Nc1ccc(C2=C(Cl)CCN(c3nccs3)C2)cc1)c1c(F)cccc1F
• InChI: InChI=1S/C22H17F4N5O.C21H16ClF2N3OS.C21H20ClFN6O.C20H17ClF2N6O.C20H17ClFN5OS.ClH/c1-12-4-6-31(21-15(24)3-2-5-27-21)11-14(12)18-9-29-19(10-28-18)30-22(32)20-16(25)7-13(23)8-17(20)26;22-16-8-10-27(21-25-9-11-29-21)12-15(16)13-4-6-14(7-5-13)26-20(28)19-17(23)2-1-3-18(19)24;1-13-10-11-29(21-25-27-28(2)26-21)12-17(13)14-6-8-15(9-7-14)24-20(30)16-4-3-5-18(23)19(16)22;1-28-26-20(25-27-28)29-10-9-15(21)14(11-29)12-5-7-13(8-6-12)24-19(30)18-16(22)3-2-4-17(18)23;1-12-4-6-27(20-23-5-7-29-20)11-15(12)17-9-25-18(10-24-17)26-19(28)14-8-13(22)2-3-16(14)21;/h2-3,5,7-10H,4,6,11H2,1H3,(H,29,30,32);1-7,9,11H,8,10,12H2,(H,26,28);3-9H,10-12H2,1-2H3,(H,24,30);2-8H,9-11H2,1H3,(H,24,30);2-3,5,7-10H,4,6,11H2,1H3,(H,25,26,28);1H
• InChIKey: GKGDQHJUEPWJMR-UHFFFAOYSA-N
• XLogP: 22.52
• TPSA: 339.13 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 27
• Rotatable Bonds: 20
• Heavy Atoms: 151
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2199.40
LogP ≤ 5	22.52
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

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

The IUPAC name of 2-chloro-3-fluoro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2-chloro-5-fluoro-N-[5-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;N-[4-[4-chloro-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;2,4,6-trifluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;hydrochloride (CID 159448206) is 2-chloro-3-fluoro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2-chloro-5-fluoro-N-[5-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;N-[4-[4-chloro-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;2,4,6-trifluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;hydrochloride.

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

The canonical SMILES for 2-chloro-3-fluoro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2-chloro-5-fluoro-N-[5-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;N-[4-[4-chloro-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;2,4,6-trifluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;hydrochloride is CC1=C(c2ccc(NC(=O)c3cccc(F)c3Cl)cc2)CN(c2nnn(C)n2)CC1.CC1=C(c2cnc(NC(=O)c3c(F)cc(F)cc3F)cn2)CN(c2ncccc2F)CC1.CC1=C(c2cnc(NC(=O)c3cc(F)ccc3Cl)cn2)CN(c2nccs2)CC1.Cl.Cn1nnc(N2CCC(Cl)=C(c3ccc(NC(=O)c4c(F)cccc4F)cc3)C2)n1.O=C(Nc1ccc(C2=C(Cl)CCN(c3nccs3)C2)cc1)c1c(F)cccc1F.

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

The InChIKey is GKGDQHJUEPWJMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17F4N5O.C21H16ClF2N3OS.C21H20ClFN6O.C20H17ClF2N6O.C20H17ClFN5OS.ClH/c1-12-4-6-31(21-15(24)3-2-5-27-21)11-14(12)18-9-29-19(10-28-18)30-22(32)20-16(25)7-13(23)8-17(20)26;22-16-8-10-27(21-25-9-11-29-21)12-15(16)13-4-6-14(7-5-13)26-20(28)19-17(23)2-1-3-18(19)24;1-13-10-11-29(21-25-27-28(2)26-21)12-17(13)14-6-8-15(9-7-14)24-20(30)16-4-3-5-18(23)19(16)22;1-28-26-20(25-27-28)29-10-9-15(21)14(11-29)12-5-7-13(8-6-12)24-19(30)18-16(22)3-2-4-17(18)23;1-12-4-6-27(20-23-5-7-29-20)11-15(12)17-9-25-18(10-24-17)26-19(28)14-8-13(22)2-3-16(14)21;/h2-3,5,7-10H,4,6,11H2,1H3,(H,29,30,32);1-7,9,11H,8,10,12H2,(H,26,28);3-9H,10-12H2,1-2H3,(H,24,30);2-8H,9-11H2,1H3,(H,24,30);2-3,5,7-10H,4,6,11H2,1H3,(H,25,26,28);1H.

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

2-chloro-3-fluoro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2-chloro-5-fluoro-N-[5-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;N-[4-[4-chloro-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;2,4,6-trifluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;hydrochloride has a molecular weight of 2199.40 g/mol, XLogP of 22.52, 20 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-3-fluoro-N-[4-[4-methyl-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2-chloro-5-fluoro-N-[5-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;N-[4-[4-chloro-1-(2-methyltetrazol-5-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;N-[4-[4-chloro-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]-2,6-difluorobenzamide;2,4,6-trifluoro-N-[5-[1-(3-fluoro-2-pyridinyl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]pyrazin-2-yl]benzamide;hydrochloride is sourced from PubChem (CID 159448206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).