5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide

C68H67N17O7S — CID 158859892

IUPAC5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(Nc2ccc(-c3ccc4c(c3)CNC4=O)n3ccnc23)cc1.COc1ncc(-c2ccc(Nc3ccc(N4CCOCC4)cc3)c3nccn23)c(OC)n1.Nc1ccc(-c2ccc(Nc3ccc(N4CCOCC4)cc3)c3nccn23)cn1
InChIInChI=1S/C23H24N6O3.C23H21N5O3S.C22H22N6O/c1-30-22-18(15-25-23(27-22)31-2)20-8-7-19(21-24-9-10-29(20)21)26-16-3-5-17(6-4-16)28-11-13-32-14-12-28;1-27(2)32(30,31)18-6-4-17(5-7-18)26-20-9-10-21(28-12-11-24-22(20)28)15-3-8-19-16(13-15)14-25-23(19)29;23-21-8-1-16(15-25-21)20-7-6-19(22-24-9-10-28(20)22)26-17-2-4-18(5-3-17)27-11-13-29-14-12-27/h3-10,15,26H,11-14H2,1-2H3;3-13,26H,14H2,1-2H3,(H,25,29);1-10,15,26H,11-14H2,(H2,23,25)
InChIKeyJANIMMZJVPNHHF-UHFFFAOYSA-N
MW1266.46 g/mol
LogP10.19
Rot. Bonds15

About 5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide

5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide (PubChem CID 158859892) has the molecular formula C68H67N17O7S and a molecular weight of 1266.46 g/mol. Its IUPAC name is 5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide.

Molecular Properties

Compound Name5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide
PubChem CID158859892
Molecular FormulaC68H67N17O7S
Molecular Weight1266.46 g/mol
Exact Mass1265.51
IUPAC Name5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(Nc2ccc(-c3ccc4c(c3)CNC4=O)n3ccnc23)cc1.COc1ncc(-c2ccc(Nc3ccc(N4CCOCC4)cc3)c3nccn23)c(OC)n1.Nc1ccc(-c2ccc(Nc3ccc(N4CCOCC4)cc3)c3nccn23)cn1
InChIInChI=1S/C23H24N6O3.C23H21N5O3S.C22H22N6O/c1-30-22-18(15-25-23(27-22)31-2)20-8-7-19(21-24-9-10-29(20)21)26-16-3-5-17(6-4-16)28-11-13-32-14-12-28;1-27(2)32(30,31)18-6-4-17(5-7-18)26-20-9-10-21(28-12-11-24-22(20)28)15-3-8-19-16(13-15)14-25-23(19)29;23-21-8-1-16(15-25-21)20-7-6-19(22-24-9-10-28(20)22)26-17-2-4-18(5-3-17)27-11-13-29-14-12-27/h3-10,15,26H,11-14H2,1-2H3;3-13,26H,14H2,1-2H3,(H,25,29);1-10,15,26H,11-14H2,(H2,23,25)
InChIKeyJANIMMZJVPNHHF-UHFFFAOYSA-N
XLogP10.19
TPSA262.56 Ų
H-Bond Donors5
H-Bond Acceptors22
Rotatable Bonds15
Heavy Atoms93
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001266.46
LogP ≤ 510.19
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide with MolForge

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Related Compounds

5-[8-[4-(Benzenesulfonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;5-[8-[4-(morpholine-4-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;5-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one
CID 157156202
N-[2-(dimethylamino)ethyl]-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(2-methoxy-4-pyridinyl)-N-[4-[4-(3-methylbutyl)piperazin-1-yl]phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-[4-[4-(3-methylbutyl)piperazin-1-yl]anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
CID 157321467
5-[8-(4-Methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;5-[8-(4-morpholin-4-ylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;5-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one
CID 157752593
6-[[9-ethyl-2-[3-(hydroxymethyl)phenyl]-6-morpholin-4-ylpurin-8-yl]methyl-methylamino]-N-methylhexanamide;4-[[[9-ethyl-2-(6-methoxy-3-pyridinyl)-6-morpholin-4-ylpurin-8-yl]methyl-methylamino]methyl]-N-methylbenzamide;3-[9-ethyl-8-[[methyl-[[4-[(E)-3-(methylamino)-3-oxoprop-1-enyl]phenyl]methyl]amino]methyl]-6-morpholin-4-ylpurin-2-yl]benzamide;(E)-3-[4-[[[9-ethyl-6-morpholin-4-yl-2-[3-(2-oxopropyl)phenyl]purin-8-yl]methyl-methylamino]methyl]phenyl]-N-methylprop-2-enamide
CID 157932265
5-(1H-indol-5-yl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;5-(2-methoxy-4-pyridinyl)-N-[4-(4-propylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;5-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one
CID 158175037
N-[4-(4-cyclohexylpiperazin-1-yl)phenyl]-5-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyridin-8-amine;N-(2-methoxyethyl)-N-methyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[8-[4-(4-propylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
CID 159037236
N-methyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide;5-[8-(4-morpholin-4-ylsulfonylanilino)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]benzenesulfonyl iodide
CID 159109865
N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide;5-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one
CID 159206619
4-[[[2-(2-aminopyrimidin-5-yl)-9-ethyl-6-morpholin-4-ylpurin-8-yl]methyl-methylamino]methyl]-N-methylbenzamide;N-[8-(2,6-dimorpholin-4-ylpurin-9-yl)oct-1-en-2-yl]hydroxylamine;7-(2,6-dipyrrolidin-1-ylpurin-9-yl)-N-hydroxyheptanamide;N-[4-[9-ethyl-8-[[[4-[(1E)-3-(hydroxyamino)buta-1,3-dienyl]phenyl]methyl-methylamino]methyl]-6-morpholin-4-ylpurin-2-yl]phenyl]methanesulfonamide;4-[[[9-ethyl-2-(6-methoxy-3-pyridinyl)-6-morpholin-4-ylpurin-8-yl]methyl-methylamino]methyl]-N-methylbenzamide
CID 159546960
(E)-3-[4-[[[2-(6-amino-3-pyridinyl)-9-ethyl-6-morpholin-4-ylpurin-8-yl]methyl-methylamino]methyl]phenyl]-N-methylprop-2-enamide;(E)-3-[4-[[(2-chloro-9-ethyl-6-morpholin-4-ylpurin-8-yl)methyl-methylamino]methyl]phenyl]-N-methylprop-2-enamide;(E)-3-[4-[[[9-ethyl-2-[4-(methanesulfonamido)phenyl]-6-morpholin-4-ylpurin-8-yl]methyl-methylamino]methyl]phenyl]-N-methylprop-2-enamide;(E)-3-[4-[[[9-ethyl-2-(6-methoxy-3-pyridinyl)-6-morpholin-4-ylpurin-8-yl]methyl-methylamino]methyl]phenyl]-N-methylprop-2-enamide;4-[9-ethyl-8-[[methyl-[[4-[(E)-3-(methylamino)-3-oxoprop-1-enyl]phenyl]methyl]amino]methyl]-6-morpholin-4-ylpurin-2-yl]benzamide
CID 159628146
N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
CID 159744381
5-[8-[4-[4-(2-ethoxyethyl)piperazine-1-carbonyl]anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;N-[4-(4-ethylpiperazin-1-yl)phenyl]-5-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyridin-8-amine;5-(2-methoxy-4-pyridinyl)-N-[4-(4-propylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine
CID 159746330

Frequently Asked Questions

What is the IUPAC name of 5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide?
The IUPAC name of 5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide (CID 158859892) is 5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide.
What is the SMILES notation for 5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide?
The canonical SMILES for 5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide is CN(C)S(=O)(=O)c1ccc(Nc2ccc(-c3ccc4c(c3)CNC4=O)n3ccnc23)cc1.COc1ncc(-c2ccc(Nc3ccc(N4CCOCC4)cc3)c3nccn23)c(OC)n1.Nc1ccc(-c2ccc(Nc3ccc(N4CCOCC4)cc3)c3nccn23)cn1.
What is the InChIKey of 5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide?
The InChIKey is JANIMMZJVPNHHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O3.C23H21N5O3S.C22H22N6O/c1-30-22-18(15-25-23(27-22)31-2)20-8-7-19(21-24-9-10-29(20)21)26-16-3-5-17(6-4-16)28-11-13-32-14-12-28;1-27(2)32(30,31)18-6-4-17(5-7-18)26-20-9-10-21(28-12-11-24-22(20)28)15-3-8-19-16(13-15)14-25-23(19)29;23-21-8-1-16(15-25-21)20-7-6-19(22-24-9-10-28(20)22)26-17-2-4-18(5-3-17)27-11-13-29-14-12-27/h3-10,15,26H,11-14H2,1-2H3;3-13,26H,14H2,1-2H3,(H,25,29);1-10,15,26H,11-14H2,(H2,23,25).
What are the key properties of 5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide?
5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide has a molecular weight of 1266.46 g/mol, XLogP of 10.19, 15 rotatable bonds, 5 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-amino-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;5-(2,4-dimethoxypyrimidin-5-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;N,N-dimethyl-4-[[5-(1-oxo-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzenesulfonamide is sourced from PubChem (CID 158859892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).