5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one

C25H33N5O3Si — CID 70650272

IUPAC5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one
SMILESCc1ccc2ncc(-c3ccc4c(n3)n(C3CCOCC3)c(=O)n4COCC[Si](C)(C)C)n2c1
InChIInChI=1S/C25H33N5O3Si/c1-18-5-8-23-26-15-22(28(23)16-18)20-6-7-21-24(27-20)30(19-9-11-32-12-10-19)25(31)29(21)17-33-13-14-34(2,3)4/h5-8,15-16,19H,9-14,17H2,1-4H3
InChIKeyVSULHMOBMMZTFV-UHFFFAOYSA-N
MW479.66 g/mol
LogP4.48
Rot. Bonds7

About 5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one

5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one (PubChem CID 70650272) has the molecular formula C25H33N5O3Si and a molecular weight of 479.66 g/mol. Its IUPAC name is 5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one
PubChem CID70650272
Molecular FormulaC25H33N5O3Si
Molecular Weight479.66 g/mol
Exact Mass479.24
IUPAC Name5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one
SMILESCc1ccc2ncc(-c3ccc4c(n3)n(C3CCOCC3)c(=O)n4COCC[Si](C)(C)C)n2c1
InChIInChI=1S/C25H33N5O3Si/c1-18-5-8-23-26-15-22(28(23)16-18)20-6-7-21-24(27-20)30(19-9-11-32-12-10-19)25(31)29(21)17-33-13-14-34(2,3)4/h5-8,15-16,19H,9-14,17H2,1-4H3
InChIKeyVSULHMOBMMZTFV-UHFFFAOYSA-N
XLogP4.48
TPSA75.58 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500479.66
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-9-[(1S,2R)-2-methylcyclohexyl]-7-(2-trimethylsilylethoxymethyl)purin-8-one
CID 87278369
2-[2-chloro-9-(oxan-4-yl)-8-oxopurin-7-yl]acetonitrile
CID 162680307
2-(6-methylpyrimidin-4-yl)-N-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-c]pyridin-6-amine
CID 169097868
7-(oxan-4-yloxy)-3-(2-trimethylsilylethoxymethyl)-1H-imidazo[4,5-b]pyridin-2-one
CID 141469854
2-[(2-methoxy-3-pyridinyl)amino]-9-[(1S,2R)-2-methylcyclohexyl]-7-(2-trimethylsilylethoxymethyl)purin-8-one
CID 90218569
ethane;6-methyl-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
CID 145449183
6-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1-(2-trimethylsilylethoxymethyl)-1,5-naphthyridin-2-one
CID 164753329
6-chloro-4-(oxolan-3-yloxy)-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one
CID 123838783
2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-9-(oxan-4-yl)-6-piperazin-1-yl-7H-purin-8-one
CID 67123674
(1R)-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(oxan-4-yl)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine
CID 129338503
6-fluoro-3-[4-[2-(oxan-4-yloxy)ethoxy]phenyl]imidazo[1,2-a]pyridine
CID 71242959
3-(4-hydroxyphenyl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one
CID 58577628

Frequently Asked Questions

What is the IUPAC name of 5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one (CID 70650272) is 5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one is Cc1ccc2ncc(-c3ccc4c(n3)n(C3CCOCC3)c(=O)n4COCC[Si](C)(C)C)n2c1.
What is the InChIKey of 5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one?
The InChIKey is VSULHMOBMMZTFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33N5O3Si/c1-18-5-8-23-26-15-22(28(23)16-18)20-6-7-21-24(27-20)30(19-9-11-32-12-10-19)25(31)29(21)17-33-13-14-34(2,3)4/h5-8,15-16,19H,9-14,17H2,1-4H3.
What are the key properties of 5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one?
5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one has a molecular weight of 479.66 g/mol, XLogP of 4.48, 7 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-methylimidazo[1,2-a]pyridin-3-yl)-3-(oxan-4-yl)-1-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 70650272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).