5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide

C107H88Cl2F2N16O5 — CID 158296224

IUPAC5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(C)c5)ncc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)nc(Cl)c34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5ccccc5Cl)ncc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(C5CCOC5)ncc34)cnc2C)cc1
InChIInChI=1S/C28H24N4O.C27H19ClF2N4O.C27H21ClN4O.C25H24N4O2/c1-18-9-11-23(12-10-18)31-28(33)25-15-22(16-29-20(25)3)24-8-5-13-32-26(24)17-30-27(32)21-7-4-6-19(2)14-21;1-15-8-10-18(11-9-15)32-27(35)21-13-17(14-31-16(21)2)19-6-4-12-34-24(19)25(28)33-26(34)20-5-3-7-22(29)23(20)30;1-17-9-11-20(12-10-17)31-27(33)23-14-19(15-29-18(23)2)21-7-5-13-32-25(21)16-30-26(32)22-6-3-4-8-24(22)28;1-16-5-7-20(8-6-16)28-25(30)22-12-19(13-26-17(22)2)21-4-3-10-29-23(21)14-27-24(29)18-9-11-31-15-18/h4-17H,1-3H3,(H,31,33);3-14H,1-2H3,(H,32,35);3-16H,1-2H3,(H,31,33);3-8,10,12-14,18H,9,11,15H2,1-2H3,(H,28,30)
InChIKeyGLYAHOCIIOEZTA-UHFFFAOYSA-N
MW1786.89 g/mol
LogP24.46
Rot. Bonds16

About 5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide

5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide (PubChem CID 158296224) has the molecular formula C107H88Cl2F2N16O5 and a molecular weight of 1786.89 g/mol. Its IUPAC name is 5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide
PubChem CID158296224
Molecular FormulaC107H88Cl2F2N16O5
Molecular Weight1786.89 g/mol
Exact Mass1784.65
IUPAC Name5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(C)c5)ncc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)nc(Cl)c34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5ccccc5Cl)ncc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(C5CCOC5)ncc34)cnc2C)cc1
InChIInChI=1S/C28H24N4O.C27H19ClF2N4O.C27H21ClN4O.C25H24N4O2/c1-18-9-11-23(12-10-18)31-28(33)25-15-22(16-29-20(25)3)24-8-5-13-32-26(24)17-30-27(32)21-7-4-6-19(2)14-21;1-15-8-10-18(11-9-15)32-27(35)21-13-17(14-31-16(21)2)19-6-4-12-34-24(19)25(28)33-26(34)20-5-3-7-22(29)23(20)30;1-17-9-11-20(12-10-17)31-27(33)23-14-19(15-29-18(23)2)21-7-5-13-32-25(21)16-30-26(32)22-6-3-4-8-24(22)28;1-16-5-7-20(8-6-16)28-25(30)22-12-19(13-26-17(22)2)21-4-3-10-29-23(21)14-27-24(29)18-9-11-31-15-18/h4-17H,1-3H3,(H,31,33);3-14H,1-2H3,(H,32,35);3-16H,1-2H3,(H,31,33);3-8,10,12-14,18H,9,11,15H2,1-2H3,(H,28,30)
InChIKeyGLYAHOCIIOEZTA-UHFFFAOYSA-N
XLogP24.46
TPSA246.39 Ų
H-Bond Donors4
H-Bond Acceptors17
Rotatable Bonds16
Heavy Atoms132
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001786.89
LogP ≤ 524.46
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1017

Analyze 5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide?
The IUPAC name of 5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide (CID 158296224) is 5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide.
What is the SMILES notation for 5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide?
The canonical SMILES for 5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide is Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(C)c5)ncc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)nc(Cl)c34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5ccccc5Cl)ncc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(C5CCOC5)ncc34)cnc2C)cc1.
What is the InChIKey of 5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide?
The InChIKey is GLYAHOCIIOEZTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N4O.C27H19ClF2N4O.C27H21ClN4O.C25H24N4O2/c1-18-9-11-23(12-10-18)31-28(33)25-15-22(16-29-20(25)3)24-8-5-13-32-26(24)17-30-27(32)21-7-4-6-19(2)14-21;1-15-8-10-18(11-9-15)32-27(35)21-13-17(14-31-16(21)2)19-6-4-12-34-24(19)25(28)33-26(34)20-5-3-7-22(29)23(20)30;1-17-9-11-20(12-10-17)31-27(33)23-14-19(15-29-18(23)2)21-7-5-13-32-25(21)16-30-26(32)22-6-3-4-8-24(22)28;1-16-5-7-20(8-6-16)28-25(30)22-12-19(13-26-17(22)2)21-4-3-10-29-23(21)14-27-24(29)18-9-11-31-15-18/h4-17H,1-3H3,(H,31,33);3-14H,1-2H3,(H,32,35);3-16H,1-2H3,(H,31,33);3-8,10,12-14,18H,9,11,15H2,1-2H3,(H,28,30).
What are the key properties of 5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide?
5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide has a molecular weight of 1786.89 g/mol, XLogP of 24.46, 16 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(3-methylphenyl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide;2-methyl-N-(4-methylphenyl)-5-[3-(oxolan-3-yl)imidazo[1,5-a]pyridin-8-yl]pyridine-3-carboxamide is sourced from PubChem (CID 158296224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).