6-(1-Piperidinyl)pyridine-3-boronic Acid Pinacol Ester
Product Information
Molecular Formula
C16H25N2O2B
Molecular Weight
288.19
Description
6-(1-Piperidinyl)pyridine-3-boronic Acid Pinacol Ester (CAS# 852228-08-1) is a useful research chemical.
Synonyms
2-(1-piperidinyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; 2-piperidin-1-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
IUPAC Name
2-piperidin-1-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)N3CCCCC3
InChI
InChI=1S/C16H25BN2O2/c1-15(2)16(3,4)21-17(20-15)13-8-9-14(18-12-13)19-10-6-5-7-11-19/h8-9,12H,5-7,10-11H2,1-4H3
InChI Key
MLJZIQHWAUYAPA-UHFFFAOYSA-N
Boiling Point
427.8 °C at 760 mmHg
Melting Point
110-114 °C
Flash Point
Not applicable
Purity
97 %
Density
1.07 g/cm3
Appearance
Beige to yellow powder
LogP
2.43610
Safety Information
Precautionary Statement
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
288.2009082 g/mol
Monoisotopic Mass
288.2009082 g/mol
Topological Polar Surface Area
34.6Ų
Heavy Atom Count
21
Formal Charge
0
Complexity
353
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 |
|---|---|---|
| WO-2021023813-A1 | 5-heteroaryl-pyridin-2-amine confounds as neuropeptide ff receptor antagonists | 2019-08-06 |
| WO-2020247804-A1 | Heterocycle substituted pyridine derivative antifungal agents | 2019-06-07 |
| US-2020308163-A1 | Compounds and compositions as modulators of tlr signaling | 2019-03-26 |
| CN-114025847-A | Compounds and compositions as modulators of TLR signaling | 2019-03-26 |
| CN-113164476-A | Small molecule inhibitor of DYRK1/CLK and application thereof | 2018-09-28 |
| US-2022041590-A1 | Small molecule inhibitors of dyrk/clk and uses thereof | 2018-09-28 |
| US-2019322655-A1 | Novel triazolone derivatives or salts thereof and pharmaceutical compositions comprising the same | 2018-03-21 |
| WO-2019180646-A1 | Novel triazolone derivatives or salts thereof and pharmaceutical compositions comprising the same | 2018-03-21 |
| AU-2019237344-A1 | Novel triazolone derivatives or salts thereof and pharmaceutical compositions comprising the same | 2018-03-21 |
| CN-111886233-A | Novel triazolone derivative or salt thereof and pharmaceutical composition comprising the same | 2018-03-21 |
