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{6-[(2,2-Dimethylpropanoyl)amino]-3-pyridinyl}boronic acid

{6-[(2,2-Dimethylpropanoyl)amino]-3-pyridinyl}boronic acid

Inquiry

Molecular Formula:

C10H15BN2O3

Molecular Weight:

222.05

Product Information

Molecular Formula:

C10H15BN2O3

Molecular Weight:

222.05

Description

6-[(2,2-Dimethylpropanoyl)amino]-3-pyridinyl}boronic acid is an effective biomedical compound utilized primarily in cancer research, particularly in the development of targeted therapies for various types of leukemia. It plays an important role in the synthesis of inhibitor drugs.

Synonyms

6-Pivalamidopyridin-3-yl)boronic acid; {6-[(2,2-DIMETHYLPROPANOYL)AMINO]-3-PYRIDINYL}BORONIC ACID; (6-[(2,2-Dimethylpropanoyl)amino]-3-pyridinyl)boronic acid; [6-(2,2-dimethylpropanoylamino)pyridin-3-yl]boronic acid; DTXSID801163950; MFCD12198444; (6-Pivalamidopyridin-3-yl)boronicacid; 6-(pivalamido)pyridine-3-boronic acid; [6-(2,2-dimethylpropanamido)pyridin-3-yl]boronic acid; {6-[(2,2-Dimethylpropanoyl)amino]-3-pyridinyl}boronic acid; Boronic acid, B-[6-[(2,2-dimethyl-1-oxopropyl)amino]-3-pyridinyl]-

IUPAC Name

[6-(2,2-dimethylpropanoylamino)pyridin-3-yl]boronic acid

Canonical SMILES

B(C1=CN=C(C=C1)NC(=O)C(C)(C)C)(O)O

InChI

InChI=1S/C10H15BN2O3/c1-10(2,3)9(14)13-8-5-4-7(6-12-8)11(15)16/h4-6,15-16H,1-3H3,(H,12,13,14)

InChI Key

UMNSJQDICLTXBG-UHFFFAOYSA-N

Flash Point

Not applicable

Safety Information

Hazards

H302

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

222.1175725 g/mol

Monoisotopic Mass

222.1175725 g/mol

Topological Polar Surface Area

82.4Å²

Heavy Atom Count

Formal Charge

Complexity

253

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

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

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The dilution calculator equation

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

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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{6-[(2,2-Dimethylpropanoyl)amino]-3-pyridinyl}boronic acid

Product Information

Safety Information

Computed Properties

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