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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)pyridine-3-carboxamide
C110H83Cl3F4N16O4 — CID 157049749
Data last refreshed: (MolForge compound catalog, from PubChem)
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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(Cl)c5)ncc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)nc(Cl)c34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)ncc34)cnc2C2CC2)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5ccccc5Cl)ncc34)cnc2C)cc1
InChIInChI=1S/C29H22F2N4O.C27H19ClF2N4O.2C27H21ClN4O/c1-17-7-11-20(12-8-17)34-29(36)23-14-19(15-32-27(23)18-9-10-18)21-5-3-13-35-25(21)16-33-28(35)22-4-2-6-24(30)26(22)31;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;1-17-8-10-22(11-9-17)31-27(33)24-14-20(15-29-18(24)2)23-7-4-12-32-25(23)16-30-26(32)19-5-3-6-21(28)13-19;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/h2-8,11-16,18H,9-10H2,1H3,(H,34,36);3-14H,1-2H3,(H,32,35);2*3-16H,1-2H3,(H,31,33)
InChIKeyAABCSUIXDGMEBT-UHFFFAOYSA-N
MW1875.33 g/mol
LogP26.82
Rot. Bonds17
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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)pyridine-3-carboxamide (PubChem CID 157049749) has the molecular formula C110H83Cl3F4N16O4 and a molecular weight of 1875.33 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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)pyridine-3-carboxamide.
Molecular Properties
| Compound Name | 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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)pyridine-3-carboxamide |
|---|---|
| PubChem CID | 157049749 |
| Molecular Formula | C110H83Cl3F4N16O4 |
| Molecular Weight | 1875.33 g/mol |
| Exact Mass | 1872.58 |
| IUPAC Name | 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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)pyridine-3-carboxamide |
| SMILES | Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(Cl)c5)ncc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)nc(Cl)c34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)ncc34)cnc2C2CC2)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5ccccc5Cl)ncc34)cnc2C)cc1 |
| InChI | InChI=1S/C29H22F2N4O.C27H19ClF2N4O.2C27H21ClN4O/c1-17-7-11-20(12-8-17)34-29(36)23-14-19(15-32-27(23)18-9-10-18)21-5-3-13-35-25(21)16-33-28(35)22-4-2-6-24(30)26(22)31;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;1-17-8-10-22(11-9-17)31-27(33)24-14-20(15-29-18(24)2)23-7-4-12-32-25(23)16-30-26(32)19-5-3-6-21(28)13-19;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/h2-8,11-16,18H,9-10H2,1H3,(H,34,36);3-14H,1-2H3,(H,32,35);2*3-16H,1-2H3,(H,31,33) |
| InChIKey | AABCSUIXDGMEBT-UHFFFAOYSA-N |
| XLogP | 26.82 |
| TPSA | 237.16 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 17 |
| Heavy Atoms | 137 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1875.33 |
| LogP ≤ 5 | 26.82 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 16 |
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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)pyridine-3-carboxamide (CID 157049749) 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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)pyridine-3-carboxamide is Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(Cl)c5)ncc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)nc(Cl)c34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)ncc34)cnc2C2CC2)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5ccccc5Cl)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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)pyridine-3-carboxamide?
The InChIKey is AABCSUIXDGMEBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H22F2N4O.C27H19ClF2N4O.2C27H21ClN4O/c1-17-7-11-20(12-8-17)34-29(36)23-14-19(15-32-27(23)18-9-10-18)21-5-3-13-35-25(21)16-33-28(35)22-4-2-6-24(30)26(22)31;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;1-17-8-10-22(11-9-17)31-27(33)24-14-20(15-29-18(24)2)23-7-4-12-32-25(23)16-30-26(32)19-5-3-6-21(28)13-19;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/h2-8,11-16,18H,9-10H2,1H3,(H,34,36);3-14H,1-2H3,(H,32,35);2*3-16H,1-2H3,(H,31,33).
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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)pyridine-3-carboxamide has a molecular weight of 1875.33 g/mol, XLogP of 26.82, 17 rotatable bonds, 4 hydrogen bond donors, and 16 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;5-[3-(3-chlorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;2-cyclopropyl-5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 157049749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 157049749 — identifiers, structure, computed properties (public domain)
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