6-(Methylamino)pyridine-3-boronic acid pinacol ester - CAS 1005009-98-2

Name: 6-(Methylamino)pyridine-3-boronic acid pinacol ester
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB000241
Product Name:	6-(Methylamino)pyridine-3-boronic acid pinacol ester
CAS:	1005009-98-2
Synonyms:	N-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinamine; N-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine

Technical Data

IUPAC Name:	N-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine
Description:	6-(Methylamino)pyridine-3-boronic acid pinacol ester (CAS# 1005009-98-2) is a useful research chemical.
Molecular Weight:	234.1
Molecular Formula:	C12H19BN2O2
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)NC
InChI:	InChI=1S/C12H19BN2O2/c1-11(2)12(3,4)17-13(16-11)9-6-7-10(14-5)15-8-9/h6-8H,1-5H3,(H,14,15)
InChI Key:	ANKKLMBIFAUZOP-UHFFFAOYSA-N
Appearance:	Solid
Storage:	Keep in dark place, Inert atmosphere, 2-8 °C
LogP:	1.49550

Publication Number	Title	Priority Date
US-2020078364-A1	Combination therapy with a phosphoinositide 3-kinase inhibitor with a zinc binding moiety	20180911
KR-20210087438-A	Combination therapy with phosphoinositide 3-kinase inhibitors with zinc binding moieties	20180911
TW-202016106-A	Novel isoxazolate derivatives as GABA-AÎ±5 forward ectopic regulator (PAM)	20180613
BR-112020025355-A2	ISOXAZOLYL Ether DERIVATIVES AS GABA TO ALFA5 PAM	20180613
CN-112424196-A	Novel isoxazolyl ether derivatives as GABAA alpha 5 PAM	20180613

Complexity:	268
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	234.153958
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	234.153958
Rotatable Bond Count:	2
Topological Polar Surface Area:	43.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0