2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide

C147H144F20N16O7 — CID 160748549

About 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide

2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide (PubChem CID 160748549) has the molecular formula C147H144F20N16O7 and a molecular weight of 2626.83 g/mol. Its IUPAC name is 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide.

Molecular Properties

• Compound Name: 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide
• PubChem CID: 160748549
• Molecular Formula: C147H144F20N16O7
• Molecular Weight: 2626.83 g/mol
• Exact Mass: 2625.11
• IUPAC Name: 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide
• SMILES: CC(C)C(=O)Nc1ccc(C2=C(C(F)(F)F)CC3CCCC23)cn1.CC1=C(c2cnc(NC(=O)c3ccccc3C)cn2)CC2CCCC2C1.CC1=C(c2cnc(NC(=O)c3ccccc3F)cn2)CC2CCCC2C1.Cc1ccccc1C(=O)Nc1ccc(C2=C(C(F)(F)F)CC3CCCC23)cn1.O=C(Nc1ccc(C2=C(C(F)(F)F)CC3CCCC23)cn1)c1c(F)cccc1F.O=C(Nc1ccc(C2=C(C(F)(F)F)CC3CCCC23)cn1)c1ccccc1F.O=C(Nc1ccc(C2=C(C(F)(F)F)CC3CCCC3C2)cn1)c1ccccc1F
• InChI: InChI=1S/C22H20F4N2O.C22H21F3N2O.C22H25N3O.C21H17F5N2O.C21H18F4N2O.C21H22FN3O.C18H21F3N2O/c23-19-7-2-1-6-16(19)21(29)28-20-9-8-15(12-27-20)17-10-13-4-3-5-14(13)11-18(17)22(24,25)26;1-13-5-2-3-7-16(13)21(28)27-19-10-9-15(12-26-19)20-17-8-4-6-14(17)11-18(20)22(23,24)25;1-14-6-3-4-9-18(14)22(26)25-21-13-23-20(12-24-21)19-11-17-8-5-7-16(17)10-15(19)2;22-15-5-2-6-16(23)19(15)20(29)28-17-8-7-12(10-27-17)18-13-4-1-3-11(13)9-14(18)21(24,25)26;22-17-7-2-1-5-15(17)20(28)27-18-9-8-13(11-26-18)19-14-6-3-4-12(14)10-16(19)21(23,24)25;1-13-9-14-5-4-6-15(14)10-17(13)19-11-24-20(12-23-19)25-21(26)16-7-2-3-8-18(16)22;1-10(2)17(24)23-15-7-6-12(9-22-15)16-13-5-3-4-11(13)8-14(16)18(19,20)21/h1-2,6-9,12-14H,3-5,10-11H2,(H,27,28,29);2-3,5,7,9-10,12,14,17H,4,6,8,11H2,1H3,(H,26,27,28);3-4,6,9,12-13,16-17H,5,7-8,10-11H2,1-2H3,(H,24,25,26);2,5-8,10-11,13H,1,3-4,9H2,(H,27,28,29);1-2,5,7-9,11-12,14H,3-4,6,10H2,(H,26,27,28);2-3,7-8,11-12,14-15H,4-6,9-10H2,1H3,(H,24,25,26);6-7,9-11,13H,3-5,8H2,1-2H3,(H,22,23,24)
• InChIKey: RWMXPBLRHHWJSF-UHFFFAOYSA-N
• XLogP: 37.82
• TPSA: 319.71 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 16
• Rotatable Bonds: 21
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2626.83
LogP ≤ 5	37.82
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide?

The IUPAC name of 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide (CID 160748549) is 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide.

What is the SMILES notation for 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide?

The canonical SMILES for 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide is CC(C)C(=O)Nc1ccc(C2=C(C(F)(F)F)CC3CCCC23)cn1.CC1=C(c2cnc(NC(=O)c3ccccc3C)cn2)CC2CCCC2C1.CC1=C(c2cnc(NC(=O)c3ccccc3F)cn2)CC2CCCC2C1.Cc1ccccc1C(=O)Nc1ccc(C2=C(C(F)(F)F)CC3CCCC23)cn1.O=C(Nc1ccc(C2=C(C(F)(F)F)CC3CCCC23)cn1)c1c(F)cccc1F.O=C(Nc1ccc(C2=C(C(F)(F)F)CC3CCCC23)cn1)c1ccccc1F.O=C(Nc1ccc(C2=C(C(F)(F)F)CC3CCCC3C2)cn1)c1ccccc1F.

What is the InChIKey of 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide?

The InChIKey is RWMXPBLRHHWJSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20F4N2O.C22H21F3N2O.C22H25N3O.C21H17F5N2O.C21H18F4N2O.C21H22FN3O.C18H21F3N2O/c23-19-7-2-1-6-16(19)21(29)28-20-9-8-15(12-27-20)17-10-13-4-3-5-14(13)11-18(17)22(24,25)26;1-13-5-2-3-7-16(13)21(28)27-19-10-9-15(12-26-19)20-17-8-4-6-14(17)11-18(20)22(23,24)25;1-14-6-3-4-9-18(14)22(26)25-21-13-23-20(12-24-21)19-11-17-8-5-7-16(17)10-15(19)2;22-15-5-2-6-16(23)19(15)20(29)28-17-8-7-12(10-27-17)18-13-4-1-3-11(13)9-14(18)21(24,25)26;22-17-7-2-1-5-15(17)20(28)27-18-9-8-13(11-26-18)19-14-6-3-4-12(14)10-16(19)21(23,24)25;1-13-9-14-5-4-6-15(14)10-17(13)19-11-24-20(12-23-19)25-21(26)16-7-2-3-8-18(16)22;1-10(2)17(24)23-15-7-6-12(9-22-15)16-13-5-3-4-11(13)8-14(16)18(19,20)21/h1-2,6-9,12-14H,3-5,10-11H2,(H,27,28,29);2-3,5,7,9-10,12,14,17H,4,6,8,11H2,1H3,(H,26,27,28);3-4,6,9,12-13,16-17H,5,7-8,10-11H2,1-2H3,(H,24,25,26);2,5-8,10-11,13H,1,3-4,9H2,(H,27,28,29);1-2,5,7-9,11-12,14H,3-4,6,10H2,(H,26,27,28);2-3,7-8,11-12,14-15H,4-6,9-10H2,1H3,(H,24,25,26);6-7,9-11,13H,3-5,8H2,1-2H3,(H,22,23,24).

What are the key properties of 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide?

2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide has a molecular weight of 2626.83 g/mol, XLogP of 37.82, 21 rotatable bonds, 7 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 2,6-difluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyrazin-2-yl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]benzamide;2-methyl-N-[5-[2-(trifluoromethyl)-3,3a,4,5,6,6a-hexahydropentalen-1-yl]-2-pyridinyl]propanamide is sourced from PubChem (CID 160748549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).