N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide

C106H107F4N21O14S2 — CID 167699761

IUPACN-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide
SMILESC.Cc1cc(-c2nc(C(=O)Nc3cn4cc(C(C)(C)O)nc4cc3-c3cc(F)cc(F)c3)co2)ccn1.Cc1cc(-c2nc(C(=O)Nc3cn4cc(CCC(C)(C)O)nc4cc3N3CCCCC3)co2)ccn1.Cc1cc(-c2nc(C(=O)Nc3cn4cc(CCS(C)(=O)=O)nc4cc3N3CCCCC3)co2)ccn1.Cc1cccc(-c2nc(C(=O)Nc3cn4cc(CCS(C)(=O)=O)nc4cc3-c3cc(F)cc(F)c3)co2)c1
InChIInChI=1S/C27H22F2N4O4S.C27H32N6O3.C26H21F2N5O3.C25H28N6O4S.CH4/c1-16-4-3-5-17(8-16)27-32-24(15-37-27)26(34)31-23-14-33-13-21(6-7-38(2,35)36)30-25(33)12-22(23)18-9-19(28)11-20(29)10-18;1-18-13-19(8-10-28-18)26-31-22(17-36-26)25(34)30-21-16-33-15-20(7-9-27(2,3)35)29-24(33)14-23(21)32-11-5-4-6-12-32;1-14-6-15(4-5-29-14)25-31-21(13-36-25)24(34)30-20-11-33-12-22(26(2,3)35)32-23(33)10-19(20)16-7-17(27)9-18(28)8-16;1-17-12-18(6-8-26-17)25-29-21(16-35-25)24(32)28-20-15-31-14-19(7-11-36(2,33)34)27-23(31)13-22(20)30-9-4-3-5-10-30;/h3-5,8-15H,6-7H2,1-2H3,(H,31,34);8,10,13-17,35H,4-7,9,11-12H2,1-3H3,(H,30,34);4-13,35H,1-3H3,(H,30,34);6,8,12-16H,3-5,7,9-11H2,1-2H3,(H,28,32);1H4
InChIKeyYEVCQIBNIQUIAA-UHFFFAOYSA-N
MW2039.28 g/mol
LogP19.00
Rot. Bonds26

About N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide

N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide (PubChem CID 167699761) has the molecular formula C106H107F4N21O14S2 and a molecular weight of 2039.28 g/mol. Its IUPAC name is N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide
PubChem CID167699761
Molecular FormulaC106H107F4N21O14S2
Molecular Weight2039.28 g/mol
Exact Mass2037.77
IUPAC NameN-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide
SMILESC.Cc1cc(-c2nc(C(=O)Nc3cn4cc(C(C)(C)O)nc4cc3-c3cc(F)cc(F)c3)co2)ccn1.Cc1cc(-c2nc(C(=O)Nc3cn4cc(CCC(C)(C)O)nc4cc3N3CCCCC3)co2)ccn1.Cc1cc(-c2nc(C(=O)Nc3cn4cc(CCS(C)(=O)=O)nc4cc3N3CCCCC3)co2)ccn1.Cc1cccc(-c2nc(C(=O)Nc3cn4cc(CCS(C)(=O)=O)nc4cc3-c3cc(F)cc(F)c3)co2)c1
InChIInChI=1S/C27H22F2N4O4S.C27H32N6O3.C26H21F2N5O3.C25H28N6O4S.CH4/c1-16-4-3-5-17(8-16)27-32-24(15-37-27)26(34)31-23-14-33-13-21(6-7-38(2,35)36)30-25(33)12-22(23)18-9-19(28)11-20(29)10-18;1-18-13-19(8-10-28-18)26-31-22(17-36-26)25(34)30-21-16-33-15-20(7-9-27(2,3)35)29-24(33)14-23(21)32-11-5-4-6-12-32;1-14-6-15(4-5-29-14)25-31-21(13-36-25)24(34)30-20-11-33-12-22(26(2,3)35)32-23(33)10-19(20)16-7-17(27)9-18(28)8-16;1-17-12-18(6-8-26-17)25-29-21(16-35-25)24(32)28-20-15-31-14-19(7-11-36(2,33)34)27-23(31)13-22(20)30-9-4-3-5-10-30;/h3-5,8-15H,6-7H2,1-2H3,(H,31,34);8,10,13-17,35H,4-7,9,11-12H2,1-3H3,(H,30,34);4-13,35H,1-3H3,(H,30,34);6,8,12-16H,3-5,7,9-11H2,1-2H3,(H,28,32);1H4
InChIKeyYEVCQIBNIQUIAA-UHFFFAOYSA-N
XLogP19.00
TPSA443.61 Ų
H-Bond Donors6
H-Bond Acceptors31
Rotatable Bonds26
Heavy Atoms147
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002039.28
LogP ≤ 519.00
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1031

Analyze N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide?
The IUPAC name of N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide (CID 167699761) is N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide is C.Cc1cc(-c2nc(C(=O)Nc3cn4cc(C(C)(C)O)nc4cc3-c3cc(F)cc(F)c3)co2)ccn1.Cc1cc(-c2nc(C(=O)Nc3cn4cc(CCC(C)(C)O)nc4cc3N3CCCCC3)co2)ccn1.Cc1cc(-c2nc(C(=O)Nc3cn4cc(CCS(C)(=O)=O)nc4cc3N3CCCCC3)co2)ccn1.Cc1cccc(-c2nc(C(=O)Nc3cn4cc(CCS(C)(=O)=O)nc4cc3-c3cc(F)cc(F)c3)co2)c1.
What is the InChIKey of N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide?
The InChIKey is YEVCQIBNIQUIAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22F2N4O4S.C27H32N6O3.C26H21F2N5O3.C25H28N6O4S.CH4/c1-16-4-3-5-17(8-16)27-32-24(15-37-27)26(34)31-23-14-33-13-21(6-7-38(2,35)36)30-25(33)12-22(23)18-9-19(28)11-20(29)10-18;1-18-13-19(8-10-28-18)26-31-22(17-36-26)25(34)30-21-16-33-15-20(7-9-27(2,3)35)29-24(33)14-23(21)32-11-5-4-6-12-32;1-14-6-15(4-5-29-14)25-31-21(13-36-25)24(34)30-20-11-33-12-22(26(2,3)35)32-23(33)10-19(20)16-7-17(27)9-18(28)8-16;1-17-12-18(6-8-26-17)25-29-21(16-35-25)24(32)28-20-15-31-14-19(7-11-36(2,33)34)27-23(31)13-22(20)30-9-4-3-5-10-30;/h3-5,8-15H,6-7H2,1-2H3,(H,31,34);8,10,13-17,35H,4-7,9,11-12H2,1-3H3,(H,30,34);4-13,35H,1-3H3,(H,30,34);6,8,12-16H,3-5,7,9-11H2,1-2H3,(H,28,32);1H4.
What are the key properties of N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide?
N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide has a molecular weight of 2039.28 g/mol, XLogP of 19.00, 26 rotatable bonds, 6 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(3,5-difluorophenyl)-2-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;N-[7-(3,5-difluorophenyl)-2-(2-methylsulfonylethyl)imidazo[1,2-a]pyridin-6-yl]-2-(3-methylphenyl)-1,3-oxazole-4-carboxamide;N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide;methane;2-(2-methyl-4-pyridinyl)-N-[2-(2-methylsulfonylethyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 167699761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).