HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

5-(1-Methyl-4-pyrazolyl)pyridine-3-boronic Acid Pinacol Ester

HCID 67362964
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cn1cc(-c2cncc(B3OC(C)(C)C(C)(C)O3)c2)cn1
InChIKey
HFZIZUJPOHOYGZ-UHFFFAOYSA-N
Molecular formula
C15H20BN3O2
Average molar mass
285.15 g/mol

Names & identifiers

Preferred name
5-(1-Methyl-4-pyrazolyl)pyridine-3-boronic Acid Pinacol Ester
IUPAC
3-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

Names & synonyms

1171892-77-55-(1-Methyl-4-pyrazolyl)pyridine-3-boronic Acid Pinacol EsterMFCD233815333-(1-methyl-1H-pyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine5-(1-METHYL-1H-PYRAZOL-4-YL)PYRIDINE-3-BORONIC ACID PINACOL ESTER3-(1-methyl-1H-pyrazol-4-yl)-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyridineSCHEMBL2320747HFZIZUJPOHOYGZ-UHFFFAOYSA-NCS-31894DA-15073SY377038G80866

Database identifiers

PubChem CID
67362964

Properties

Computed structural properties

Topological polar surface area
49.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
21
Formal charge
0
Complexity
375

Related reactions

3 records
New reaction record
HRID 1231590 reaction equation
HRID 1231590As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1404290 reaction equation
HRID 1404290As reactantuspto-grants-2014_12
HRID 1914941 reaction equation
HRID 1914941As reactantuspto-grants-2013_12

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes