N-[5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]acetamide

Product Information

Molecular Formula:
C13H19BN2O3
Molecular Weight:
262.113
Description
N-[5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]acetamide is a remarkable biomedical versatile compound that holds significant promise in combating select diseases. Demonstrating its power as an impressive inhibitor, it effectively thwarts the progression of these ailments by specifically targeting and neutralizing crucial enzymes.
Synonyms
N-[5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridyl]acetamide
IUPAC Name
N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]acetamide
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)NC(=O)C
InChI
InChI=1S/C13H19BN2O3/c1-9(17)16-11-7-6-10(8-15-11)14-18-12(2,3)13(4,5)19-14/h6-8H,1-5H3,(H,15,16,17)
InChI Key
YCWPTBAHVWJMEY-UHFFFAOYSA-N
Melting Point
130-134 °C
Flash Point
Not applicable
Purity
97%

Safety Information

Hazards
H315 - H319 - H335
Precautionary Statement
P302 + P352 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
262.1488726 g/mol
Monoisotopic Mass
262.1488726 g/mol
Topological Polar Surface Area
60.4Ų
Heavy Atom Count
19
Formal Charge
0
Complexity
344
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
US-2020361939-A1 Modulators of alpha-1 antitrypsin 2019-05-14
TW-202104223-A Phosphatidylinositol 3-kinase inhibitors 2019-04-10
CN-114025756-A Phosphatidylinositol 3-kinase inhibitors 2019-04-10
KR-20210150491-A Phosphatidylinositol 3-kinase inhibitor 2019-04-10
US-2019076401-A1 Cyanoindazole compounds and uses thereof 2017-09-08
US-10722495-B2 Cyanoindazole compounds and uses thereof 2017-09-08
EA-038109-B1 INHIBITORS OF WDR5 PROTEIN BINDING WITH PROTEINS 2016-03-01
KR-20180025896-A As IRAK-4 inhibitors, indazole and azindazole compounds 2015-07-15
US-2018201609-A1 Indazole and azaindazole compounds as irak-4 inhibitors 2015-07-15
US-10266532-B2 Tricyclic modulators of TNF signaling 2015-04-17
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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