N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide

C97H97N23O7 — CID 158566585

IUPACN-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide
SMILESCC(C)CNC(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.CCN(C)CCN(CC)C(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.Cc1ccccc1CNC(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.O=C(NC1CCNC1)c1ccc(Nc2ccc(-c3cn[nH]c3)n3ccnc23)cc1
InChIInChI=1S/C27H23N5O2.C26H30N6O2.C23H23N5O2.C21H21N7O/c1-18-4-2-3-5-21(18)17-30-27(34)19-6-8-22(9-7-19)31-23-10-11-24(32-15-14-29-26(23)32)20-12-13-28-25(33)16-20;1-4-30(3)16-17-31(5-2)26(34)19-6-8-21(9-7-19)29-22-10-11-23(32-15-14-28-25(22)32)20-12-13-27-24(33)18-20;1-15(2)14-26-23(30)16-3-5-18(6-4-16)27-19-7-8-20(28-12-11-25-22(19)28)17-9-10-24-21(29)13-17;29-21(27-17-7-8-22-13-17)14-1-3-16(4-2-14)26-18-5-6-19(15-11-24-25-12-15)28-10-9-23-20(18)28/h2-16,31H,17H2,1H3,(H,28,33)(H,30,34);6-15,18,29H,4-5,16-17H2,1-3H3,(H,27,33);3-13,15,27H,14H2,1-2H3,(H,24,29)(H,26,30);1-6,9-12,17,22,26H,7-8,13H2,(H,24,25)(H,27,29)
InChIKeyHROAMFGIIAZLOE-UHFFFAOYSA-N
MW1697.00 g/mol
LogP14.90
Rot. Bonds26

About N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide

N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide (PubChem CID 158566585) has the molecular formula C97H97N23O7 and a molecular weight of 1697.00 g/mol. Its IUPAC name is N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide.

Molecular Properties

Compound NameN-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide
PubChem CID158566585
Molecular FormulaC97H97N23O7
Molecular Weight1697.00 g/mol
Exact Mass1695.79
IUPAC NameN-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide
SMILESCC(C)CNC(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.CCN(C)CCN(CC)C(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.Cc1ccccc1CNC(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.O=C(NC1CCNC1)c1ccc(Nc2ccc(-c3cn[nH]c3)n3ccnc23)cc1
InChIInChI=1S/C27H23N5O2.C26H30N6O2.C23H23N5O2.C21H21N7O/c1-18-4-2-3-5-21(18)17-30-27(34)19-6-8-22(9-7-19)31-23-10-11-24(32-15-14-29-26(23)32)20-12-13-28-25(33)16-20;1-4-30(3)16-17-31(5-2)26(34)19-6-8-21(9-7-19)29-22-10-11-23(32-15-14-28-25(22)32)20-12-13-27-24(33)18-20;1-15(2)14-26-23(30)16-3-5-18(6-4-16)27-19-7-8-20(28-12-11-25-22(19)28)17-9-10-24-21(29)13-17;29-21(27-17-7-8-22-13-17)14-1-3-16(4-2-14)26-18-5-6-19(15-11-24-25-12-15)28-10-9-23-20(18)28/h2-16,31H,17H2,1H3,(H,28,33)(H,30,34);6-15,18,29H,4-5,16-17H2,1-3H3,(H,27,33);3-13,15,27H,14H2,1-2H3,(H,24,29)(H,26,30);1-6,9-12,17,22,26H,7-8,13H2,(H,24,25)(H,27,29)
InChIKeyHROAMFGIIAZLOE-UHFFFAOYSA-N
XLogP14.90
TPSA367.46 Ų
H-Bond Donors12
H-Bond Acceptors22
Rotatable Bonds26
Heavy Atoms127
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001697.00
LogP ≤ 514.90
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1022

Analyze N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide with MolForge

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Related Compounds

N-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]amino]ethyl]-2-[4-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazin-1-yl]acetamide
CID 146410948
2-(2,6-dioxopiperidin-3-yl)-5-[[5-[4-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazin-1-yl]-5-oxopentyl]amino]isoindole-1,3-dione
CID 146411074
N-[5-[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-4-yl]pentyl]-4-[[4-(1-propylpyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide
CID 155599246
N-[5-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-4-yl]amino]pentyl]-4-[[4-(1-propylpyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide
CID 162675943
PTK6-IN-21b
CID 53484181
PROTAC CDK2/9 Degrader-1
CID 145925673
2-(2,6-dioxopiperidin-3-yl)-5-[2-[4-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazin-1-yl]ethylamino]isoindole-1,3-dione
CID 149683645
[3-fluoro-4-[[6-methyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-piperazin-1-ylmethanone
CID 53484170
(2,2-dimethylpiperazin-1-yl)-[3-fluoro-4-[[6-methyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]methanone
CID 53484182
[4-[[6-cyclopropyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-3-fluorophenyl]-(2,2-dimethylpiperazin-1-yl)methanone
CID 53484183
[4-[[6-cyclopropyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-3-fluorophenyl]-(3,3-dimethylpiperazin-1-yl)methanone
CID 53484184
[4-[[6-methyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-piperazin-1-ylmethanone
CID 56658841

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide?
The IUPAC name of N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide (CID 158566585) is N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide.
What is the SMILES notation for N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide?
The canonical SMILES for N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide is CC(C)CNC(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.CCN(C)CCN(CC)C(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.Cc1ccccc1CNC(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.O=C(NC1CCNC1)c1ccc(Nc2ccc(-c3cn[nH]c3)n3ccnc23)cc1.
What is the InChIKey of N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide?
The InChIKey is HROAMFGIIAZLOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23N5O2.C26H30N6O2.C23H23N5O2.C21H21N7O/c1-18-4-2-3-5-21(18)17-30-27(34)19-6-8-22(9-7-19)31-23-10-11-24(32-15-14-29-26(23)32)20-12-13-28-25(33)16-20;1-4-30(3)16-17-31(5-2)26(34)19-6-8-21(9-7-19)29-22-10-11-23(32-15-14-28-25(22)32)20-12-13-27-24(33)18-20;1-15(2)14-26-23(30)16-3-5-18(6-4-16)27-19-7-8-20(28-12-11-25-22(19)28)17-9-10-24-21(29)13-17;29-21(27-17-7-8-22-13-17)14-1-3-16(4-2-14)26-18-5-6-19(15-11-24-25-12-15)28-10-9-23-20(18)28/h2-16,31H,17H2,1H3,(H,28,33)(H,30,34);6-15,18,29H,4-5,16-17H2,1-3H3,(H,27,33);3-13,15,27H,14H2,1-2H3,(H,24,29)(H,26,30);1-6,9-12,17,22,26H,7-8,13H2,(H,24,25)(H,27,29).
What are the key properties of N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide?
N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide has a molecular weight of 1697.00 g/mol, XLogP of 14.90, 26 rotatable bonds, 12 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-[(2-methylphenyl)methyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;N-(2-methylpropyl)-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N-pyrrolidin-3-ylbenzamide is sourced from PubChem (CID 158566585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).