5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one

C98H90FN21O7 — CID 160534978

IUPAC5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
SMILESCC(=O)CCCNC(=O)c1ccc(Nc2ccc(-c3ccc4c(c3)CNC4=O)n3ccnc23)cc1.C[C@@H]1CN(C)[C@@H](C)CN1c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.Fc1cc(-c2ccc(Nc3ccc(N4CCOCC4)cc3)c3nccn23)ccn1.O=C1NCc2cc(-c3ccc(Nc4ccc(-c5cnco5)cc4)c4nccn34)ccc21
InChIInChI=1S/C27H25N5O3.C25H28N6O.C24H17N5O2.C22H20FN5O/c1-17(33)3-2-12-29-26(34)18-4-7-21(8-5-18)31-23-10-11-24(32-14-13-28-25(23)32)19-6-9-22-20(15-19)16-30-27(22)35;1-17-16-31(18(2)15-29(17)3)21-6-4-20(5-7-21)28-22-8-9-23(30-13-12-27-25(22)30)19-10-11-26-24(32)14-19;30-24-19-6-3-16(11-17(19)12-27-24)21-8-7-20(23-26-9-10-29(21)23)28-18-4-1-15(2-5-18)22-13-25-14-31-22;23-21-15-16(7-8-24-21)20-6-5-19(22-25-9-10-28(20)22)26-17-1-3-18(4-2-17)27-11-13-29-14-12-27/h4-11,13-15,31H,2-3,12,16H2,1H3,(H,29,34)(H,30,35);4-14,17-18,28H,15-16H2,1-3H3,(H,26,32);1-11,13-14,28H,12H2,(H,27,30);1-10,15,26H,11-14H2/t;17-,18+;;/m.0../s1
InChIKeyQWAPTKJZYTXAML-LEGISQSZSA-N
MW1692.94 g/mol
LogP16.81
Rot. Bonds20

About 5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one

5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one (PubChem CID 160534978) has the molecular formula C98H90FN21O7 and a molecular weight of 1692.94 g/mol. Its IUPAC name is 5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
PubChem CID160534978
Molecular FormulaC98H90FN21O7
Molecular Weight1692.94 g/mol
Exact Mass1691.73
IUPAC Name5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
SMILESCC(=O)CCCNC(=O)c1ccc(Nc2ccc(-c3ccc4c(c3)CNC4=O)n3ccnc23)cc1.C[C@@H]1CN(C)[C@@H](C)CN1c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.Fc1cc(-c2ccc(Nc3ccc(N4CCOCC4)cc3)c3nccn23)ccn1.O=C1NCc2cc(-c3ccc(Nc4ccc(-c5cnco5)cc4)c4nccn34)ccc21
InChIInChI=1S/C27H25N5O3.C25H28N6O.C24H17N5O2.C22H20FN5O/c1-17(33)3-2-12-29-26(34)18-4-7-21(8-5-18)31-23-10-11-24(32-14-13-28-25(23)32)19-6-9-22-20(15-19)16-30-27(22)35;1-17-16-31(18(2)15-29(17)3)21-6-4-20(5-7-21)28-22-8-9-23(30-13-12-27-25(22)30)19-10-11-26-24(32)14-19;30-24-19-6-3-16(11-17(19)12-27-24)21-8-7-20(23-26-9-10-29(21)23)28-18-4-1-15(2-5-18)22-13-25-14-31-22;23-21-15-16(7-8-24-21)20-6-5-19(22-25-9-10-28(20)22)26-17-1-3-18(4-2-17)27-11-13-29-14-12-27/h4-11,13-15,31H,2-3,12,16H2,1H3,(H,29,34)(H,30,35);4-14,17-18,28H,15-16H2,1-3H3,(H,26,32);1-11,13-14,28H,12H2,(H,27,30);1-10,15,26H,11-14H2/t;17-,18+;;/m.0../s1
InChIKeyQWAPTKJZYTXAML-LEGISQSZSA-N
XLogP16.81
TPSA312.42 Ų
H-Bond Donors8
H-Bond Acceptors24
Rotatable Bonds20
Heavy Atoms127
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001692.94
LogP ≤ 516.81
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one with MolForge

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Related Compounds

5-[8-[4-(4-morpholin-4-ylbutanoyl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one
CID 123870535
4-[8-[4-(4-cyclopropylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-[4-(4-cyclopropylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[(5-methyl-1,2-oxazol-3-yl)methyl]-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide
CID 159943943
4-[8-[[4-(4-ethyl-2,5-dimethylpiperazin-1-yl)-3-methylphenyl]methyl]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;1-[3-methyl-5-[8-[(4-morpholin-4-ylphenyl)methyl]imidazo[1,2-a]pyridin-5-yl]phenyl]ethanone
CID 160815480
ethane;5-[8-(4-piperidin-1-ylanilino)imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one
CID 123850246
ethane;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzoic acid
CID 143681962
N-butyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-2-methyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[8-(4-piperidin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
CID 158164147
N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide
CID 24990032
4-[8-[4-[(2S,5R)-2,4,5-trimethylpiperazin-1-yl]anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-1H-pyridin-2-one
CID 24945945
4-[8-[4-(2,6-dimethylmorpholin-4-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
CID 71091658
N,N-dimethyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide
CID 58046117
5-[8-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)amino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one
CID 58046201
4-[8-[4-(4-benzylpiperazine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(1-phenylcyclopropyl)benzamide;1-[4-[8-[4-(4-propylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]phenyl]ethanone
CID 158380247

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?
The IUPAC name of 5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one (CID 160534978) is 5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one.
What is the SMILES notation for 5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?
The canonical SMILES for 5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one is CC(=O)CCCNC(=O)c1ccc(Nc2ccc(-c3ccc4c(c3)CNC4=O)n3ccnc23)cc1.C[C@@H]1CN(C)[C@@H](C)CN1c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.Fc1cc(-c2ccc(Nc3ccc(N4CCOCC4)cc3)c3nccn23)ccn1.O=C1NCc2cc(-c3ccc(Nc4ccc(-c5cnco5)cc4)c4nccn34)ccc21.
What is the InChIKey of 5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?
The InChIKey is QWAPTKJZYTXAML-LEGISQSZSA-N. The full InChI is InChI=1S/C27H25N5O3.C25H28N6O.C24H17N5O2.C22H20FN5O/c1-17(33)3-2-12-29-26(34)18-4-7-21(8-5-18)31-23-10-11-24(32-14-13-28-25(23)32)19-6-9-22-20(15-19)16-30-27(22)35;1-17-16-31(18(2)15-29(17)3)21-6-4-20(5-7-21)28-22-8-9-23(30-13-12-27-25(22)30)19-10-11-26-24(32)14-19;30-24-19-6-3-16(11-17(19)12-27-24)21-8-7-20(23-26-9-10-29(21)23)28-18-4-1-15(2-5-18)22-13-25-14-31-22;23-21-15-16(7-8-24-21)20-6-5-19(22-25-9-10-28(20)22)26-17-1-3-18(4-2-17)27-11-13-29-14-12-27/h4-11,13-15,31H,2-3,12,16H2,1H3,(H,29,34)(H,30,35);4-14,17-18,28H,15-16H2,1-3H3,(H,26,32);1-11,13-14,28H,12H2,(H,27,30);1-10,15,26H,11-14H2/t;17-,18+;;/m.0../s1.
What are the key properties of 5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?
5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one has a molecular weight of 1692.94 g/mol, XLogP of 16.81, 20 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluoro-4-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-[8-[4-(1,3-oxazol-5-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-(4-oxopentyl)benzamide;4-[8-[4-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one is sourced from PubChem (CID 160534978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).