5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide

C83H60F9N11O4 — CID 160517791

IUPAC5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)ncn34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)c(CO)nc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)cnc34)ccc2C(F)(F)F)cc1
InChIInChI=1S/C28H18F5N3O.C28H22F2N4O2.C27H20F2N4O/c1-16-7-10-18(11-8-16)35-27(37)21-14-17(9-12-22(21)28(31,32)33)19-5-3-13-36-24(15-34-26(19)36)20-4-2-6-23(29)25(20)30;1-16-8-10-19(11-9-16)32-28(36)22-13-18(14-31-17(22)2)20-6-4-12-34-26(24(15-35)33-27(20)34)21-5-3-7-23(29)25(21)30;1-16-9-11-19(12-10-16)32-27(34)21-13-18(14-30-17(21)2)23-7-4-8-24-26(31-15-33(23)24)20-5-3-6-22(28)25(20)29/h2-15H,1H3,(H,35,37);3-14,35H,15H2,1-2H3,(H,32,36);3-15H,1-2H3,(H,32,34)
InChIKeyQTWOTPZHUSWCKA-UHFFFAOYSA-N
MW1446.45 g/mol
LogP19.44
Rot. Bonds13

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

5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide (PubChem CID 160517791) has the molecular formula C83H60F9N11O4 and a molecular weight of 1446.45 g/mol. Its IUPAC name is 5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide
PubChem CID160517791
Molecular FormulaC83H60F9N11O4
Molecular Weight1446.45 g/mol
Exact Mass1445.47
IUPAC Name5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)ncn34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)c(CO)nc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)cnc34)ccc2C(F)(F)F)cc1
InChIInChI=1S/C28H18F5N3O.C28H22F2N4O2.C27H20F2N4O/c1-16-7-10-18(11-8-16)35-27(37)21-14-17(9-12-22(21)28(31,32)33)19-5-3-13-36-24(15-34-26(19)36)20-4-2-6-23(29)25(20)30;1-16-8-10-19(11-9-16)32-28(36)22-13-18(14-31-17(22)2)20-6-4-12-34-26(24(15-35)33-27(20)34)21-5-3-7-23(29)25(21)30;1-16-9-11-19(12-10-16)32-27(34)21-13-18(14-30-17(21)2)23-7-4-8-24-26(31-15-33(23)24)20-5-3-6-22(28)25(20)29/h2-15H,1H3,(H,35,37);3-14,35H,15H2,1-2H3,(H,32,36);3-15H,1-2H3,(H,32,34)
InChIKeyQTWOTPZHUSWCKA-UHFFFAOYSA-N
XLogP19.44
TPSA185.21 Ų
H-Bond Donors4
H-Bond Acceptors12
Rotatable Bonds13
Heavy Atoms107
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001446.45
LogP ≤ 519.44
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1012

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

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Related Compounds

2-fluoro-N-[3-(1-hydroxyethyl)-7-phenylimidazo[1,2-a]pyridin-8-yl]-5-pyridin-2-yl-4-(trifluoromethyl)benzamide
CID 122609213
2-fluoro-N-[3-(hydroxymethyl)-7-phenylimidazo[1,2-a]pyridin-8-yl]-5-pyridin-2-yl-4-(trifluoromethyl)benzamide
CID 122604102
2-fluoro-N-[7-[3-(hydroxymethyl)phenyl]-3-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-8-yl]-5-pyrimidin-2-yl-4-(trifluoromethyl)benzamide
CID 122609266
US11186579, Example 21
CID 146307453
US11186579, Example 28
CID 146307520
US11186579, Example 14
CID 146341411
US11186579, Example 2
CID 146307393
2-(5-Fluoro-2-(hydroxymethyl)-3-(8-(5-(4-methylpiperazin-1-yl)pyridin-2-ylamino)imidazo[1,2-a]pyridin-6-yl)phenyl)-3,4,6,7,8,9-hexahydropyrazino[1,2-a]indol-1(2H)-one
CID 71553863
2-fluoro-N-[7-[2-[4-fluoro-5-[[5-(1-hydroxyethyl)-2-phenyl-1H-indol-3-yl]carbamoyl]-2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-5-(1-hydroxyethyl)-2-phenyl-1H-indol-3-yl]-5-pyrimidin-2-yl-4-(trifluoromethyl)benzamide
CID 123599674
N-[4-methyl-3-[8-[(3R)-3-[[6-[2-methyl-5-[[3-(trifluoromethyl)benzoyl]amino]phenyl]-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]morpholin-4-yl]imidazo[1,2-a]pyrazin-6-yl]phenyl]-3-(trifluoromethyl)benzamide
CID 130425569
2-fluoro-N-[3-[(1S)-1-hydroxyethyl]-7-phenylimidazo[1,2-a]pyridin-8-yl]-5-pyridin-2-yl-4-(trifluoromethyl)benzamide
CID 140861926
N-(4-fluorophenyl)-5-[2-(hydroxymethyl)-3-[(2E,4Z)-5-(methylideneamino)penta-2,4-dien-2-yl]imidazo[1,2-a]pyridin-8-yl]-2-(trifluoromethyl)benzamide
CID 147370985

Frequently Asked Questions

What is the IUPAC name of 5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide?
The IUPAC name of 5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide (CID 160517791) is 5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide.
What is the SMILES notation for 5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide?
The canonical SMILES for 5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide is Cc1ccc(NC(=O)c2cc(-c3cccc4c(-c5cccc(F)c5F)ncn34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)c(CO)nc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)cnc34)ccc2C(F)(F)F)cc1.
What is the InChIKey of 5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide?
The InChIKey is QTWOTPZHUSWCKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H18F5N3O.C28H22F2N4O2.C27H20F2N4O/c1-16-7-10-18(11-8-16)35-27(37)21-14-17(9-12-22(21)28(31,32)33)19-5-3-13-36-24(15-34-26(19)36)20-4-2-6-23(29)25(20)30;1-16-8-10-19(11-9-16)32-28(36)22-13-18(14-31-17(22)2)20-6-4-12-34-26(24(15-35)33-27(20)34)21-5-3-7-23(29)25(21)30;1-16-9-11-19(12-10-16)32-27(34)21-13-18(14-30-17(21)2)23-7-4-8-24-26(31-15-33(23)24)20-5-3-6-22(28)25(20)29/h2-15H,1H3,(H,35,37);3-14,35H,15H2,1-2H3,(H,32,36);3-15H,1-2H3,(H,32,34).
What are the key properties of 5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide?
5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide has a molecular weight of 1446.45 g/mol, XLogP of 19.44, 13 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 160517791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).