methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde

C73H90N18O5Si2 — CID 161022573

IUPACmethyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde
SMILESCOC(=O)c1ccc(Nc2nc(C)cn3c(-c4cnn(COCC[Si](C)(C)C)c4)cnc23)cc1C.Cc1cn2c(-c3cnn(COCC[Si](C)(C)C)c3)cnc2c(Nc2ccc(C=O)c(C)c2)n1.Cc1cn2c(C3=CCN=C3)cnc2c(Nc2ccc(CN3CCCCC3)c(C)c2)n1
InChIInChI=1S/C25H32N6O3Si.C24H30N6O2Si.C24H28N6/c1-17-11-20(7-8-21(17)25(32)33-3)29-23-24-26-13-22(31(24)14-18(2)28-23)19-12-27-30(15-19)16-34-9-10-35(4,5)6;1-17-10-21(7-6-19(17)15-31)28-23-24-25-12-22(30(24)13-18(2)27-23)20-11-26-29(14-20)16-32-8-9-33(3,4)5;1-17-12-21(7-6-20(17)16-29-10-4-3-5-11-29)28-23-24-26-14-22(19-8-9-25-13-19)30(24)15-18(2)27-23/h7-8,11-15H,9-10,16H2,1-6H3,(H,28,29);6-7,10-15H,8-9,16H2,1-5H3,(H,27,28);6-8,12-15H,3-5,9-11,16H2,1-2H3,(H,27,28)
InChIKeyTYOIFZYZZNPTCA-UHFFFAOYSA-N
MW1355.82 g/mol
LogP14.67
Rot. Bonds23

About methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde

methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde (PubChem CID 161022573) has the molecular formula C73H90N18O5Si2 and a molecular weight of 1355.82 g/mol. Its IUPAC name is methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde.

Molecular Properties

Compound Namemethyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde
PubChem CID161022573
Molecular FormulaC73H90N18O5Si2
Molecular Weight1355.82 g/mol
Exact Mass1354.69
IUPAC Namemethyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde
SMILESCOC(=O)c1ccc(Nc2nc(C)cn3c(-c4cnn(COCC[Si](C)(C)C)c4)cnc23)cc1C.Cc1cn2c(-c3cnn(COCC[Si](C)(C)C)c3)cnc2c(Nc2ccc(C=O)c(C)c2)n1.Cc1cn2c(C3=CCN=C3)cnc2c(Nc2ccc(CN3CCCCC3)c(C)c2)n1
InChIInChI=1S/C25H32N6O3Si.C24H30N6O2Si.C24H28N6/c1-17-11-20(7-8-21(17)25(32)33-3)29-23-24-26-13-22(31(24)14-18(2)28-23)19-12-27-30(15-19)16-34-9-10-35(4,5)6;1-17-10-21(7-6-19(17)15-31)28-23-24-25-12-22(30(24)13-18(2)27-23)20-11-26-29(14-20)16-32-8-9-33(3,4)5;1-17-12-21(7-6-20(17)16-29-10-4-3-5-11-29)28-23-24-26-14-22(19-8-9-25-13-19)30(24)15-18(2)27-23/h7-8,11-15H,9-10,16H2,1-6H3,(H,28,29);6-7,10-15H,8-9,16H2,1-5H3,(H,27,28);6-8,12-15H,3-5,9-11,16H2,1-2H3,(H,27,28)
InChIKeyTYOIFZYZZNPTCA-UHFFFAOYSA-N
XLogP14.67
TPSA239.73 Ų
H-Bond Donors3
H-Bond Acceptors23
Rotatable Bonds23
Heavy Atoms98
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001355.82
LogP ≤ 514.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde with MolForge

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Related Compounds

methyl 4-[[6-bromo-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]-2-methylbenzoate
CID 59503605
[5-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]thiophen-3-yl]-pyrrolidin-1-ylmethanone
CID 59503537
5-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazole-3-carbaldehyde;[5-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]methanol
CID 157088992
methyl 5-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]-(2-trimethylsilylethoxymethyl)amino]-1,2-thiazole-3-carboxylate
CID 59503775
3-(azidomethyl)-N-[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine
CID 59503788
N-[2-(dimethylamino)ethyl]-N-ethyl-5-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-3-carboxamide
CID 59503776
3-(1-ethylpyrazol-4-yl)-6-methyl-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine
CID 143756374
methyl 5-[[3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazole-3-carboxylate;[5-[[3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]methanol
CID 158971759
3-(azepan-1-ylmethyl)-N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide
CID 143756298
N-(4-chlorophenyl)formamide;N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine
CID 143756047
N-methyl-2-[[2-[4-[6-methyl-8-[[3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-yl]amino]imidazo[1,2-a]pyrazin-3-yl]pyrazol-1-yl]acetyl]amino]acetamide
CID 59503535
N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-[(2-hydroxyphenyl)methyl]formamide
CID 143756688

Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde?
The IUPAC name of methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde (CID 161022573) is methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde.
What is the SMILES notation for methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde?
The canonical SMILES for methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde is COC(=O)c1ccc(Nc2nc(C)cn3c(-c4cnn(COCC[Si](C)(C)C)c4)cnc23)cc1C.Cc1cn2c(-c3cnn(COCC[Si](C)(C)C)c3)cnc2c(Nc2ccc(C=O)c(C)c2)n1.Cc1cn2c(C3=CCN=C3)cnc2c(Nc2ccc(CN3CCCCC3)c(C)c2)n1.
What is the InChIKey of methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde?
The InChIKey is TYOIFZYZZNPTCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N6O3Si.C24H30N6O2Si.C24H28N6/c1-17-11-20(7-8-21(17)25(32)33-3)29-23-24-26-13-22(31(24)14-18(2)28-23)19-12-27-30(15-19)16-34-9-10-35(4,5)6;1-17-10-21(7-6-19(17)15-31)28-23-24-25-12-22(30(24)13-18(2)27-23)20-11-26-29(14-20)16-32-8-9-33(3,4)5;1-17-12-21(7-6-20(17)16-29-10-4-3-5-11-29)28-23-24-26-14-22(19-8-9-25-13-19)30(24)15-18(2)27-23/h7-8,11-15H,9-10,16H2,1-6H3,(H,28,29);6-7,10-15H,8-9,16H2,1-5H3,(H,27,28);6-8,12-15H,3-5,9-11,16H2,1-2H3,(H,27,28).
What are the key properties of methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde?
methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde has a molecular weight of 1355.82 g/mol, XLogP of 14.67, 23 rotatable bonds, 3 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoate;6-methyl-N-[3-methyl-4-(piperidin-1-ylmethyl)phenyl]-3-(2H-pyrrol-4-yl)imidazo[1,2-a]pyrazin-8-amine;2-methyl-4-[[6-methyl-3-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzaldehyde is sourced from PubChem (CID 161022573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).