2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide

C93H113Cl3IN15O11Si2 — CID 158500235

IUPAC2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide
SMILESCC(=O)NC(C)(C)c1ccc(O)cc1.CC(=O)NC(C)(C)c1ccc(Oc2nc3cc(Cl)c(-c4ccc(N5CCOCC5)cc4)nc3n2COCC[Si](C)(C)C)cc1.CC(=O)NC(C)(C)c1ccc(Oc2nc3nc(-c4ccc(N5CCOCC5)cc4)c(Cl)cc3[nH]2)cc1.C[Si](C)(C)CCOCn1c(I)nc2cc(Cl)c(-c3ccc(N4CCOCC4)cc3)nc21
InChIInChI=1S/C33H42ClN5O4Si.C27H28ClN5O3.C22H28ClIN4O2Si.C11H15NO2/c1-23(40)37-33(2,3)25-9-13-27(14-10-25)43-32-35-29-21-28(34)30(36-31(29)39(32)22-42-19-20-44(4,5)6)24-7-11-26(12-8-24)38-15-17-41-18-16-38;1-17(34)32-27(2,3)19-6-10-21(11-7-19)36-26-29-23-16-22(28)24(30-25(23)31-26)18-4-8-20(9-5-18)33-12-14-35-15-13-33;1-31(2,3)13-12-30-15-28-21-19(25-22(28)24)14-18(23)20(26-21)16-4-6-17(7-5-16)27-8-10-29-11-9-27;1-8(13)12-11(2,3)9-4-6-10(14)7-5-9/h7-14,21H,15-20,22H2,1-6H3,(H,37,40);4-11,16H,12-15H2,1-3H3,(H,32,34)(H,29,30,31);4-7,14H,8-13,15H2,1-3H3;4-7,14H,1-3H3,(H,12,13)
InChIKeyHJUJCYREWFWSDC-UHFFFAOYSA-N
MW1906.46 g/mol
LogP19.61
Rot. Bonds26

About 2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide

2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide (PubChem CID 158500235) has the molecular formula C93H113Cl3IN15O11Si2 and a molecular weight of 1906.46 g/mol. Its IUPAC name is 2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide
PubChem CID158500235
Molecular FormulaC93H113Cl3IN15O11Si2
Molecular Weight1906.46 g/mol
Exact Mass1903.64
IUPAC Name2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide
SMILESCC(=O)NC(C)(C)c1ccc(O)cc1.CC(=O)NC(C)(C)c1ccc(Oc2nc3cc(Cl)c(-c4ccc(N5CCOCC5)cc4)nc3n2COCC[Si](C)(C)C)cc1.CC(=O)NC(C)(C)c1ccc(Oc2nc3nc(-c4ccc(N5CCOCC5)cc4)c(Cl)cc3[nH]2)cc1.C[Si](C)(C)CCOCn1c(I)nc2cc(Cl)c(-c3ccc(N4CCOCC4)cc3)nc21
InChIInChI=1S/C33H42ClN5O4Si.C27H28ClN5O3.C22H28ClIN4O2Si.C11H15NO2/c1-23(40)37-33(2,3)25-9-13-27(14-10-25)43-32-35-29-21-28(34)30(36-31(29)39(32)22-42-19-20-44(4,5)6)24-7-11-26(12-8-24)38-15-17-41-18-16-38;1-17(34)32-27(2,3)19-6-10-21(11-7-19)36-26-29-23-16-22(28)24(30-25(23)31-26)18-4-8-20(9-5-18)33-12-14-35-15-13-33;1-31(2,3)13-12-30-15-28-21-19(25-22(28)24)14-18(23)20(26-21)16-4-6-17(7-5-16)27-8-10-29-11-9-27;1-8(13)12-11(2,3)9-4-6-10(14)7-5-9/h7-14,21H,15-20,22H2,1-6H3,(H,37,40);4-11,16H,12-15H2,1-3H3,(H,32,34)(H,29,30,31);4-7,14H,8-13,15H2,1-3H3;4-7,14H,1-3H3,(H,12,13)
InChIKeyHJUJCYREWFWSDC-UHFFFAOYSA-N
XLogP19.61
TPSA284.85 Ų
H-Bond Donors5
H-Bond Acceptors22
Rotatable Bonds26
Heavy Atoms125
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001906.46
LogP ≤ 519.61
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide with MolForge

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Related Compounds

N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide
CID 56932840
N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide
CID 89696272
N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]-2-hydroxyacetamide
CID 89696740
N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]-2,2-dimethylpropanamide
CID 89696794
4-[2-[4-[6-chloro-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenoxy]ethyl]morpholine;N-[3-[6-chloro-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]acetamide
CID 157500766
tert-butyl 4-[2-(4-phenylmethoxyphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-5-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;2-[[5-chloro-2-(4-phenylmethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;methane;2-(4-phenylmethoxyphenyl)-5-piperazin-1-yl-1H-imidazo[4,5-b]pyridine
CID 157777924
N-[2-[4-[[6-chloro-5-[4-[4-[[dimethyl(oxo)-lambda6-sulfanylidene]amino]phenyl]phenyl]-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-[4-[4-[[dimethyl(oxo)-lambda6-sulfanylidene]amino]phenyl]phenyl]-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-[4-[5,6-dichloro-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;dimethyl-oxo-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]imino-lambda6-sulfane
CID 158832197
2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[5-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]-2-pyridinyl]propan-2-yl]acetamide;N-[2-[5-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxy-2-pyridinyl]propan-2-yl]acetamide;deuteride;N-[2-(5-hydroxy-2-pyridinyl)propan-2-yl]acetamide
CID 158915380
tert-butyl 3-oxo-4-[2-(4-phenylmethoxyphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-5-yl]piperazine-1-carboxylate;2-[[5-chloro-2-(4-phenylmethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;methane;1-[2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridin-5-yl]piperazin-2-one
CID 159001331
5-[(5-benzyl-6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)oxy]-2-methylbenzoic acid;5-[[6-chloro-5-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]-2-methylbenzoic acid;2-methyl-5-[[5-methyl-6-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]benzoic acid
CID 159253088
2-[[5-chloro-2-(4-phenylmethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;methane;methyl-[4-[[2-(4-phenylmethoxyphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-5-yl]methyl]piperazin-1-yl]borinic acid;2-(4-phenylmethoxyphenyl)-5-(piperazin-1-ylmethyl)-1H-imidazo[4,5-b]pyridine
CID 159289519
boranuide;2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;3-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]benzoic acid;methyl 3-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxybenzoate;methyl 3-hydroxybenzoate
CID 161288361

Frequently Asked Questions

What is the IUPAC name of 2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide?
The IUPAC name of 2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide (CID 158500235) is 2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide.
What is the SMILES notation for 2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide?
The canonical SMILES for 2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide is CC(=O)NC(C)(C)c1ccc(O)cc1.CC(=O)NC(C)(C)c1ccc(Oc2nc3cc(Cl)c(-c4ccc(N5CCOCC5)cc4)nc3n2COCC[Si](C)(C)C)cc1.CC(=O)NC(C)(C)c1ccc(Oc2nc3nc(-c4ccc(N5CCOCC5)cc4)c(Cl)cc3[nH]2)cc1.C[Si](C)(C)CCOCn1c(I)nc2cc(Cl)c(-c3ccc(N4CCOCC4)cc3)nc21.
What is the InChIKey of 2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide?
The InChIKey is HJUJCYREWFWSDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H42ClN5O4Si.C27H28ClN5O3.C22H28ClIN4O2Si.C11H15NO2/c1-23(40)37-33(2,3)25-9-13-27(14-10-25)43-32-35-29-21-28(34)30(36-31(29)39(32)22-42-19-20-44(4,5)6)24-7-11-26(12-8-24)38-15-17-41-18-16-38;1-17(34)32-27(2,3)19-6-10-21(11-7-19)36-26-29-23-16-22(28)24(30-25(23)31-26)18-4-8-20(9-5-18)33-12-14-35-15-13-33;1-31(2,3)13-12-30-15-28-21-19(25-22(28)24)14-18(23)20(26-21)16-4-6-17(7-5-16)27-8-10-29-11-9-27;1-8(13)12-11(2,3)9-4-6-10(14)7-5-9/h7-14,21H,15-20,22H2,1-6H3,(H,37,40);4-11,16H,12-15H2,1-3H3,(H,32,34)(H,29,30,31);4-7,14H,8-13,15H2,1-3H3;4-7,14H,1-3H3,(H,12,13).
What are the key properties of 2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide?
2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide has a molecular weight of 1906.46 g/mol, XLogP of 19.61, 26 rotatable bonds, 5 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-chloro-2-iodo-5-(4-morpholin-4-ylphenyl)imidazo[4,5-b]pyridin-3-yl]methoxy]ethyl-trimethylsilane;N-[2-[4-[[6-chloro-5-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]phenyl]propan-2-yl]acetamide;N-[2-[4-[6-chloro-5-(4-morpholin-4-ylphenyl)-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-yl]oxyphenyl]propan-2-yl]acetamide;N-[2-(4-hydroxyphenyl)propan-2-yl]acetamide is sourced from PubChem (CID 158500235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).