(2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid

C8H9BN2O2 — CID 142510514

IUPAC(2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid
SMILESCc1cn2ccc(B(O)O)cc2n1
InChIInChI=1S/C8H9BN2O2/c1-6-5-11-3-2-7(9(12)13)4-8(11)10-6/h2-5,12-13H,1H3
InChIKeyYYKDSHVFTQJGFR-UHFFFAOYSA-N
MW175.98 g/mol
LogP-0.68
Rot. Bonds1

About (2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid

(2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid (PubChem CID 142510514) has the molecular formula C8H9BN2O2 and a molecular weight of 175.98 g/mol. Its IUPAC name is (2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid.

Molecular Properties

Compound Name(2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid
PubChem CID142510514
Molecular FormulaC8H9BN2O2
Molecular Weight175.98 g/mol
Exact Mass176.08
IUPAC Name(2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid
SMILESCc1cn2ccc(B(O)O)cc2n1
InChIInChI=1S/C8H9BN2O2/c1-6-5-11-3-2-7(9(12)13)4-8(11)10-6/h2-5,12-13H,1H3
InChIKeyYYKDSHVFTQJGFR-UHFFFAOYSA-N
XLogP-0.68
TPSA57.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.98
LogP ≤ 5-0.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

[2-(hydroxymethyl)imidazo[1,2-a]pyridin-7-yl]boronic acid
CID 170984913
(2-ethoxycarbonylimidazo[1,2-a]pyridin-7-yl)boronic acid
CID 167350393
1-(2-methylimidazo[1,2-a]pyridin-7-yl)ethanone
CID 84654894
(2-methylimidazo[1,2-a]pyridin-7-yl)methanol;hydrochloride
CID 19883453
(8-chloro-2-methylimidazo[1,2-a]pyridin-6-yl)boronic acid
CID 166000239
2-methyl-3-(2-methylimidazo[1,2-a]pyridin-7-yl)propanoic acid
CID 83836460
2-methyl-7-(1H-1,2,4-triazol-5-ylmethyl)imidazo[1,2-a]pyridine
CID 126624957
N-[(2-methylimidazo[1,2-a]pyridin-7-yl)methyl]benzamide
CID 129141052
ethane;methyl-(2-methylimidazo[1,2-b]pyridazin-7-yl)borinic acid
CID 172582527
(2-methylquinolin-7-yl)boronic acid
CID 58343921
2,7-dimethylimidazo[1,2-a]pyridin-6-amine;hydrochloride
CID 121348410
2-methyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)imidazo[1,2-a]pyridine-7-carboxamide
CID 167872306

Frequently Asked Questions

What is the IUPAC name of (2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid?
The IUPAC name of (2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid (CID 142510514) is (2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid.
What is the SMILES notation for (2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid?
The canonical SMILES for (2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid is Cc1cn2ccc(B(O)O)cc2n1.
What is the InChIKey of (2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid?
The InChIKey is YYKDSHVFTQJGFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9BN2O2/c1-6-5-11-3-2-7(9(12)13)4-8(11)10-6/h2-5,12-13H,1H3.
What are the key properties of (2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid?
(2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid has a molecular weight of 175.98 g/mol, XLogP of -0.68, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylimidazo[1,2-a]pyridin-7-yl)boronic acid is sourced from PubChem (CID 142510514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).