5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane

C112H77ClF17N13O4 — CID 158454383

IUPAC5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane
SMILESC.Cc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)cnn34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)nc(Cl)n34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)ncn34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)ccc2C)cc1
InChIInChI=1S/C28H17ClF5N3O.2C28H18F5N3O.C27H20F2N4O.CH4/c1-15-8-11-17(12-9-15)35-26(38)19-14-16(10-13-20(19)28(32,33)34)22-6-3-7-23-25(36-27(29)37(22)23)18-4-2-5-21(30)24(18)31;1-16-8-11-18(12-9-16)35-27(37)20-14-17(10-13-22(20)28(31,32)33)24-6-3-7-25-21(15-34-36(24)25)19-4-2-5-23(29)26(19)30;1-16-8-11-18(12-9-16)35-27(37)20-14-17(10-13-21(20)28(31,32)33)23-6-3-7-24-26(34-15-36(23)24)19-4-2-5-22(29)25(19)30;1-16-6-10-19(11-7-16)32-27(34)22-14-18(9-8-17(22)2)20-12-13-31-33-24(15-30-26(20)33)21-4-3-5-23(28)25(21)29;/h2-14H,1H3,(H,35,38);2*2-15H,1H3,(H,35,37);3-15H,1-2H3,(H,32,34);1H4
InChIKeyHEJUBVPEKTZWRL-UHFFFAOYSA-N
MW2027.35 g/mol
LogP30.08
Rot. Bonds16

About 5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane

5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane (PubChem CID 158454383) has the molecular formula C112H77ClF17N13O4 and a molecular weight of 2027.35 g/mol. Its IUPAC name is 5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane.

Molecular Properties

Compound Name5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane
PubChem CID158454383
Molecular FormulaC112H77ClF17N13O4
Molecular Weight2027.35 g/mol
Exact Mass2025.56
IUPAC Name5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane
SMILESC.Cc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)cnn34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)nc(Cl)n34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)ncn34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)ccc2C)cc1
InChIInChI=1S/C28H17ClF5N3O.2C28H18F5N3O.C27H20F2N4O.CH4/c1-15-8-11-17(12-9-15)35-26(38)19-14-16(10-13-20(19)28(32,33)34)22-6-3-7-23-25(36-27(29)37(22)23)18-4-2-5-21(30)24(18)31;1-16-8-11-18(12-9-16)35-27(37)20-14-17(10-13-22(20)28(31,32)33)24-6-3-7-25-21(15-34-36(24)25)19-4-2-5-23(29)26(19)30;1-16-8-11-18(12-9-16)35-27(37)20-14-17(10-13-21(20)28(31,32)33)23-6-3-7-24-26(34-15-36(23)24)19-4-2-5-22(29)25(19)30;1-16-6-10-19(11-7-16)32-27(34)22-14-18(9-8-17(22)2)20-12-13-31-33-24(15-30-26(20)33)21-4-3-5-23(28)25(21)29;/h2-14H,1H3,(H,35,38);2*2-15H,1H3,(H,35,37);3-15H,1-2H3,(H,32,34);1H4
InChIKeyHEJUBVPEKTZWRL-UHFFFAOYSA-N
XLogP30.08
TPSA198.49 Ų
H-Bond Donors4
H-Bond Acceptors13
Rotatable Bonds16
Heavy Atoms147
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002027.35
LogP ≤ 530.08
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1013

Analyze 5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane with MolForge

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Related Compounds

N-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]amino]ethyl]-2-[4-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazin-1-yl]acetamide
CID 146410948
2-(2,6-dioxopiperidin-3-yl)-5-[[5-[4-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazin-1-yl]-5-oxopentyl]amino]isoindole-1,3-dione
CID 146411074
4-[8-amino-3-[(1R,3S)-3-(2-methyltetrazol-5-yl)cyclohexyl]imidazo[1,5-a]pyrazin-1-yl]-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 137648135
2-(2,6-dioxopiperidin-3-yl)-5-[2-[4-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazin-1-yl]ethylamino]isoindole-1,3-dione
CID 149683645
N-(6-(2-(4-Fluorophenyl)-5,6,7,8-tetrahydroimidazo [1,2-a]pyrazin-3-yl)imidazo[1,2-b]pyridazin-2-yl)-3-(pyridin-3-yl)benzamide
CID 76283051
4-[8-amino-3-[(7S)-3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-7-yl]imidazo[1,5-a]pyrazin-1-yl]-N-[4-(trifluoromethyl)pyridin-2-yl]benzamide
CID 76902179
N-[6-[3-(4-fluorophenyl)-1-methyl-5-pyridin-4-ylpyrazol-4-yl]imidazo[1,2-b]pyridazin-2-yl]-3-pyridin-3-ylbenzamide
CID 118537213
N-(6-(4-(4-Fluorophenyl)-1,2-dimethyl-1H-imidazol-5-yl)imidazo[1,2-b]pyridazin-2-yl)-2,4-dimethyl-5-(pyridin-3-yl)benzamide
CID 118538663
N-(6-(2-(4-Fluorophenyl)-5,6,7,8-tetrahydroimidazo [1,2-a]pyridin-3-yl)imidazo[1,2-b]pyridazin-2-yl)-3-(pyridin-3-yl)benzamide
CID 118538780
N-(6-(4-(4-Fluorophenyl)-1,2-dimethyl-1H-imidazol-5-yl)imidazo[1,2-b]pyridazin-2-yl)-2-methyl-3-(pyridin-3-yl)benzamide
CID 118539001
8-[[2-Fluoro-5-(1-methylpyrazol-3-yl)-4-(trifluoromethyl)benzoyl]amino]-7-phenylimidazo[1,2-a]pyridine-3-carboxamide
CID 122609212
N-(6-(1-(1-(4-cyanobenzoyl)piperidin-4-yl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)imidazo[1,2-b]pyridazin-2-yl)-2-fluoroisonicotinamide
CID 136214278

Frequently Asked Questions

What is the IUPAC name of 5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane?
The IUPAC name of 5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane (CID 158454383) is 5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane.
What is the SMILES notation for 5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane?
The canonical SMILES for 5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane is C.Cc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)cnn34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)nc(Cl)n34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)ncn34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)ccc2C)cc1.
What is the InChIKey of 5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane?
The InChIKey is HEJUBVPEKTZWRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H17ClF5N3O.2C28H18F5N3O.C27H20F2N4O.CH4/c1-15-8-11-17(12-9-15)35-26(38)19-14-16(10-13-20(19)28(32,33)34)22-6-3-7-23-25(36-27(29)37(22)23)18-4-2-5-21(30)24(18)31;1-16-8-11-18(12-9-16)35-27(37)20-14-17(10-13-22(20)28(31,32)33)24-6-3-7-25-21(15-34-36(24)25)19-4-2-5-23(29)26(19)30;1-16-8-11-18(12-9-16)35-27(37)20-14-17(10-13-21(20)28(31,32)33)23-6-3-7-24-26(34-15-36(23)24)19-4-2-5-22(29)25(19)30;1-16-6-10-19(11-7-16)32-27(34)22-14-18(9-8-17(22)2)20-12-13-31-33-24(15-30-26(20)33)21-4-3-5-23(28)25(21)29;/h2-14H,1H3,(H,35,38);2*2-15H,1H3,(H,35,37);3-15H,1-2H3,(H,32,34);1H4.
What are the key properties of 5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane?
5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane has a molecular weight of 2027.35 g/mol, XLogP of 30.08, 16 rotatable bonds, 4 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane is sourced from PubChem (CID 158454383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).