5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide)

C107H76F10N16O5 — CID 160695680

IUPAC5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide)
SMILESCc1cc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)ncc34)cnc2C)ccc1F.Cc1ncc(-c2cccn3c(-c4cccc(F)c4F)ncc23)cc1C(=O)Nc1ccc(OC(C)F)cc1.Cc1ncc(-c2cccn3c(-c4cccc(F)c4F)ncc23)cc1C(=O)Nc1ccccc1.Cc1ncc(-c2cccn3c(-c4cccc(F)c4F)ncc23)cc1C(=O)Nc1ccccc1
InChIInChI=1S/C28H21F3N4O2.C27H19F3N4O.2C26H18F2N4O/c1-16-23(28(36)34-19-8-10-20(11-9-19)37-17(2)29)13-18(14-32-16)21-6-4-12-35-25(21)15-33-27(35)22-5-3-7-24(30)26(22)31;1-15-11-18(8-9-22(15)28)33-27(35)21-12-17(13-31-16(21)2)19-6-4-10-34-24(19)14-32-26(34)20-5-3-7-23(29)25(20)30;2*1-16-21(26(33)31-18-7-3-2-4-8-18)13-17(14-29-16)19-10-6-12-32-23(19)15-30-25(32)20-9-5-11-22(27)24(20)28/h3-15,17H,1-2H3,(H,34,36);3-14H,1-2H3,(H,33,35);2*2-15H,1H3,(H,31,33)
InChIKeyRPYSMIKFVLZSBH-UHFFFAOYSA-N
MW1855.87 g/mol
LogP24.75
Rot. Bonds18

About 5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide)

5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide) (PubChem CID 160695680) has the molecular formula C107H76F10N16O5 and a molecular weight of 1855.87 g/mol. Its IUPAC name is 5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide).

Molecular Properties

Compound Name5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide)
PubChem CID160695680
Molecular FormulaC107H76F10N16O5
Molecular Weight1855.87 g/mol
Exact Mass1854.60
IUPAC Name5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide)
SMILESCc1cc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)ncc34)cnc2C)ccc1F.Cc1ncc(-c2cccn3c(-c4cccc(F)c4F)ncc23)cc1C(=O)Nc1ccc(OC(C)F)cc1.Cc1ncc(-c2cccn3c(-c4cccc(F)c4F)ncc23)cc1C(=O)Nc1ccccc1.Cc1ncc(-c2cccn3c(-c4cccc(F)c4F)ncc23)cc1C(=O)Nc1ccccc1
InChIInChI=1S/C28H21F3N4O2.C27H19F3N4O.2C26H18F2N4O/c1-16-23(28(36)34-19-8-10-20(11-9-19)37-17(2)29)13-18(14-32-16)21-6-4-12-35-25(21)15-33-27(35)22-5-3-7-24(30)26(22)31;1-15-11-18(8-9-22(15)28)33-27(35)21-12-17(13-31-16(21)2)19-6-4-10-34-24(19)14-32-26(34)20-5-3-7-23(29)25(20)30;2*1-16-21(26(33)31-18-7-3-2-4-8-18)13-17(14-29-16)19-10-6-12-32-23(19)15-30-25(32)20-9-5-11-22(27)24(20)28/h3-15,17H,1-2H3,(H,34,36);3-14H,1-2H3,(H,33,35);2*2-15H,1H3,(H,31,33)
InChIKeyRPYSMIKFVLZSBH-UHFFFAOYSA-N
XLogP24.75
TPSA246.39 Ų
H-Bond Donors4
H-Bond Acceptors17
Rotatable Bonds18
Heavy Atoms138
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001855.87
LogP ≤ 524.75
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1017

Analyze 5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide)?
The IUPAC name of 5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide) (CID 160695680) is 5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide).
What is the SMILES notation for 5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide)?
The canonical SMILES for 5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide) is Cc1cc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)ncc34)cnc2C)ccc1F.Cc1ncc(-c2cccn3c(-c4cccc(F)c4F)ncc23)cc1C(=O)Nc1ccc(OC(C)F)cc1.Cc1ncc(-c2cccn3c(-c4cccc(F)c4F)ncc23)cc1C(=O)Nc1ccccc1.Cc1ncc(-c2cccn3c(-c4cccc(F)c4F)ncc23)cc1C(=O)Nc1ccccc1.
What is the InChIKey of 5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide)?
The InChIKey is RPYSMIKFVLZSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21F3N4O2.C27H19F3N4O.2C26H18F2N4O/c1-16-23(28(36)34-19-8-10-20(11-9-19)37-17(2)29)13-18(14-32-16)21-6-4-12-35-25(21)15-33-27(35)22-5-3-7-24(30)26(22)31;1-15-11-18(8-9-22(15)28)33-27(35)21-12-17(13-31-16(21)2)19-6-4-10-34-24(19)14-32-26(34)20-5-3-7-23(29)25(20)30;2*1-16-21(26(33)31-18-7-3-2-4-8-18)13-17(14-29-16)19-10-6-12-32-23(19)15-30-25(32)20-9-5-11-22(27)24(20)28/h3-15,17H,1-2H3,(H,34,36);3-14H,1-2H3,(H,33,35);2*2-15H,1H3,(H,31,33).
What are the key properties of 5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide)?
5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide) has a molecular weight of 1855.87 g/mol, XLogP of 24.75, 18 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-[4-(1-fluoroethoxy)phenyl]-2-methylpyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-phenylpyridine-3-carboxamide) is sourced from PubChem (CID 160695680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).