4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide

C120H126F16N24O13 — CID 158315594

About 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide

4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide (PubChem CID 158315594) has the molecular formula C120H126F16N24O13 and a molecular weight of 2416.45 g/mol. Its IUPAC name is 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide.

Molecular Properties

• Compound Name: 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide
• PubChem CID: 158315594
• Molecular Formula: C120H126F16N24O13
• Molecular Weight: 2416.45 g/mol
• Exact Mass: 2414.97
• IUPAC Name: 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide
• SMILES: Cc1ccc(NC(=O)N2CCN(C3CCOc4cc(C(F)(F)F)ccc43)CC2)cn1.O=C(Nc1ccccc1)N1CCN(C2CCOc3cc(C(F)(F)F)ccc32)C(=O)C1.O=C(Nc1ccccc1)N1CCN(C2CCOc3cc(C(F)(F)F)ccc32)CC1.O=C(Nc1cccnc1)N1CCN(C2CCOc3cc(C(F)(F)F)ccc32)CC1.O=C(Nc1cccnn1)N1CCN(C2CCOc3c2ccc(C(F)(F)F)c3F)CC1.O=C(Nc1cccnn1)N1CCN(C2CCOc3ccccc32)CC1
• InChI: InChI=1S/C21H23F3N4O2.C21H20F3N3O3.C21H22F3N3O2.C20H21F3N4O2.C19H19F4N5O2.C18H21N5O2/c1-14-2-4-16(13-25-14)26-20(29)28-9-7-27(8-10-28)18-6-11-30-19-12-15(21(22,23)24)3-5-17(18)19;22-21(23,24)14-6-7-16-17(8-11-30-18(16)12-14)27-10-9-26(13-19(27)28)20(29)25-15-4-2-1-3-5-15;22-21(23,24)15-6-7-17-18(8-13-29-19(17)14-15)26-9-11-27(12-10-26)20(28)25-16-4-2-1-3-5-16;21-20(22,23)14-3-4-16-17(5-11-29-18(16)12-14)26-7-9-27(10-8-26)19(28)25-15-2-1-6-24-13-15;20-16-13(19(21,22)23)4-3-12-14(5-11-30-17(12)16)27-7-9-28(10-8-27)18(29)25-15-2-1-6-24-26-15;24-18(20-17-6-3-8-19-21-17)23-11-9-22(10-12-23)15-7-13-25-16-5-2-1-4-14(15)16/h2-5,12-13,18H,6-11H2,1H3,(H,26,29);1-7,12,17H,8-11,13H2,(H,25,29);1-7,14,18H,8-13H2,(H,25,28);1-4,6,12-13,17H,5,7-11H2,(H,25,28);1-4,6,14H,5,7-11H2,(H,25,26,29);1-6,8,15H,7,9-13H2,(H,20,21,24)
• InChIKey: GOFKDWDAGYHHAW-UHFFFAOYSA-N
• XLogP: 21.60
• TPSA: 363.27 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 24
• Rotatable Bonds: 12
• Heavy Atoms: 173
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2416.45
LogP ≤ 5	21.60
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide?

The IUPAC name of 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide (CID 158315594) is 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide.

What is the SMILES notation for 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide?

The canonical SMILES for 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide is Cc1ccc(NC(=O)N2CCN(C3CCOc4cc(C(F)(F)F)ccc43)CC2)cn1.O=C(Nc1ccccc1)N1CCN(C2CCOc3cc(C(F)(F)F)ccc32)C(=O)C1.O=C(Nc1ccccc1)N1CCN(C2CCOc3cc(C(F)(F)F)ccc32)CC1.O=C(Nc1cccnc1)N1CCN(C2CCOc3cc(C(F)(F)F)ccc32)CC1.O=C(Nc1cccnn1)N1CCN(C2CCOc3c2ccc(C(F)(F)F)c3F)CC1.O=C(Nc1cccnn1)N1CCN(C2CCOc3ccccc32)CC1.

What is the InChIKey of 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide?

The InChIKey is GOFKDWDAGYHHAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23F3N4O2.C21H20F3N3O3.C21H22F3N3O2.C20H21F3N4O2.C19H19F4N5O2.C18H21N5O2/c1-14-2-4-16(13-25-14)26-20(29)28-9-7-27(8-10-28)18-6-11-30-19-12-15(21(22,23)24)3-5-17(18)19;22-21(23,24)14-6-7-16-17(8-11-30-18(16)12-14)27-10-9-26(13-19(27)28)20(29)25-15-4-2-1-3-5-15;22-21(23,24)15-6-7-17-18(8-13-29-19(17)14-15)26-9-11-27(12-10-26)20(28)25-16-4-2-1-3-5-16;21-20(22,23)14-3-4-16-17(5-11-29-18(16)12-14)26-7-9-27(10-8-26)19(28)25-15-2-1-6-24-13-15;20-16-13(19(21,22)23)4-3-12-14(5-11-30-17(12)16)27-7-9-28(10-8-27)18(29)25-15-2-1-6-24-26-15;24-18(20-17-6-3-8-19-21-17)23-11-9-22(10-12-23)15-7-13-25-16-5-2-1-4-14(15)16/h2-5,12-13,18H,6-11H2,1H3,(H,26,29);1-7,12,17H,8-11,13H2,(H,25,29);1-7,14,18H,8-13H2,(H,25,28);1-4,6,12-13,17H,5,7-11H2,(H,25,28);1-4,6,14H,5,7-11H2,(H,25,26,29);1-6,8,15H,7,9-13H2,(H,20,21,24).

What are the key properties of 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide?

4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide has a molecular weight of 2416.45 g/mol, XLogP of 21.60, 12 rotatable bonds, 6 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(3,4-dihydro-2H-chromen-4-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide;4-[8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide;N-(6-methyl-3-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;3-oxo-N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-phenyl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-pyridin-3-yl-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide is sourced from PubChem (CID 158315594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).