carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol

C66H68F3N13O6Si2 — CID 159996476

IUPACcarbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol
SMILESCCc1c(-c2ccc3nccn3c2)c(-c2ccc(F)cc2)nn1COCC[Si](C)(C)C.C[Si](C)(C)CCOCn1nc(-c2ccc(F)cc2)c(-c2ccc3nccn3c2)c1CO.O=C=O.[C-]#[N+]c1cnc2ccc(-c3c(-c4ccc(F)cc4)n[nH]c3CO)cn12
InChIInChI=1S/C24H29FN4OSi.C23H27FN4O2Si.C18H12FN5O.CO2/c1-5-21-23(19-8-11-22-26-12-13-28(22)16-19)24(18-6-9-20(25)10-7-18)27-29(21)17-30-14-15-31(2,3)4;1-31(2,3)13-12-30-16-28-20(15-29)22(18-6-9-21-25-10-11-27(21)14-18)23(26-28)17-4-7-19(24)8-5-17;1-20-16-8-21-15-7-4-12(9-24(15)16)17-14(10-25)22-23-18(17)11-2-5-13(19)6-3-11;2-1-3/h6-13,16H,5,14-15,17H2,1-4H3;4-11,14,29H,12-13,15-16H2,1-3H3;2-9,25H,10H2,(H,22,23);
InChIKeyOHPJOLLOCUFAIF-UHFFFAOYSA-N
MW1252.52 g/mol
LogP13.68
Rot. Bonds19

About carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol

carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol (PubChem CID 159996476) has the molecular formula C66H68F3N13O6Si2 and a molecular weight of 1252.52 g/mol. Its IUPAC name is carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol.

Molecular Properties

Compound Namecarbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol
PubChem CID159996476
Molecular FormulaC66H68F3N13O6Si2
Molecular Weight1252.52 g/mol
Exact Mass1251.49
IUPAC Namecarbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol
SMILESCCc1c(-c2ccc3nccn3c2)c(-c2ccc(F)cc2)nn1COCC[Si](C)(C)C.C[Si](C)(C)CCOCn1nc(-c2ccc(F)cc2)c(-c2ccc3nccn3c2)c1CO.O=C=O.[C-]#[N+]c1cnc2ccc(-c3c(-c4ccc(F)cc4)n[nH]c3CO)cn12
InChIInChI=1S/C24H29FN4OSi.C23H27FN4O2Si.C18H12FN5O.CO2/c1-5-21-23(19-8-11-22-26-12-13-28(22)16-19)24(18-6-9-20(25)10-7-18)27-29(21)17-30-14-15-31(2,3)4;1-31(2,3)13-12-30-16-28-20(15-29)22(18-6-9-21-25-10-11-27(21)14-18)23(26-28)17-4-7-19(24)8-5-17;1-20-16-8-21-15-7-4-12(9-24(15)16)17-14(10-25)22-23-18(17)11-2-5-13(19)6-3-11;2-1-3/h6-13,16H,5,14-15,17H2,1-4H3;4-11,14,29H,12-13,15-16H2,1-3H3;2-9,25H,10H2,(H,22,23);
InChIKeyOHPJOLLOCUFAIF-UHFFFAOYSA-N
XLogP13.68
TPSA213.64 Ų
H-Bond Donors3
H-Bond Acceptors17
Rotatable Bonds19
Heavy Atoms90
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001252.52
LogP ≤ 513.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

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

Analyze carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

carbon dioxide;6-[5-ethyl-3-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine
CID 161020469
2-[[5-bromo-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-3-(6-methyl-2-pyridinyl)pyrazol-1-yl]methoxy]ethyl-trimethylsilane
CID 153434182
6-[3-(4-fluorophenyl)-1,5-dimethylpyrazol-4-yl]-3-isocyanoimidazo[1,2-a]pyridine
CID 161438503
2-[[4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-3-(6-methyl-2-pyridinyl)-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane
CID 153434240
6-[3-(4-fluorophenyl)-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyridine-3-carbonitrile
CID 151926075
2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane
CID 152563745
ethyl 6-[5-cyclopropyl-3-(4-fluorophenyl)-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]imidazo[1,2-a]pyridine-3-carboxylate
CID 153434238
2-[[3-(6-fluoro-2-pyridinyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)pyrazol-1-yl]methoxy]ethyl-trimethylsilane
CID 153434279
1-[4-(4-fluorophenyl)-5-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)imidazol-1-yl]-2-methylpropan-2-ol
CID 140737298
6-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-3-isocyanoimidazo[1,2-a]pyridine
CID 140737362
6-[5-cyclopropyl-3-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[5-cyclopropyl-3-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-isocyanoimidazo[1,2-a]pyridine
CID 158172983
6-[3-ethyl-5-(4-fluorophenyl)-2-nitroimidazol-4-yl]-3-isocyanoimidazo[1,2-a]pyridine
CID 157297472

Frequently Asked Questions

What is the IUPAC name of carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol?
The IUPAC name of carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol (CID 159996476) is carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol.
What is the SMILES notation for carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol?
The canonical SMILES for carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol is CCc1c(-c2ccc3nccn3c2)c(-c2ccc(F)cc2)nn1COCC[Si](C)(C)C.C[Si](C)(C)CCOCn1nc(-c2ccc(F)cc2)c(-c2ccc3nccn3c2)c1CO.O=C=O.[C-]#[N+]c1cnc2ccc(-c3c(-c4ccc(F)cc4)n[nH]c3CO)cn12.
What is the InChIKey of carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol?
The InChIKey is OHPJOLLOCUFAIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29FN4OSi.C23H27FN4O2Si.C18H12FN5O.CO2/c1-5-21-23(19-8-11-22-26-12-13-28(22)16-19)24(18-6-9-20(25)10-7-18)27-29(21)17-30-14-15-31(2,3)4;1-31(2,3)13-12-30-16-28-20(15-29)22(18-6-9-21-25-10-11-27(21)14-18)23(26-28)17-4-7-19(24)8-5-17;1-20-16-8-21-15-7-4-12(9-24(15)16)17-14(10-25)22-23-18(17)11-2-5-13(19)6-3-11;2-1-3/h6-13,16H,5,14-15,17H2,1-4H3;4-11,14,29H,12-13,15-16H2,1-3H3;2-9,25H,10H2,(H,22,23);.
What are the key properties of carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol?
carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol has a molecular weight of 1252.52 g/mol, XLogP of 13.68, 19 rotatable bonds, 3 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for carbon dioxide;2-[[5-ethyl-3-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane;[5-(4-fluorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanol;[3-(4-fluorophenyl)-4-(3-isocyanoimidazo[1,2-a]pyridin-6-yl)-1H-pyrazol-5-yl]methanol is sourced from PubChem (CID 159996476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).