4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride

C14H13ClN2O2 — CID 24761099

IUPAC4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride
SMILESCc1ccn2cc(-c3ccc(O)c(O)c3)nc2c1.Cl
InChIInChI=1S/C14H12N2O2.ClH/c1-9-4-5-16-8-11(15-14(16)6-9)10-2-3-12(17)13(18)7-10;/h2-8,17-18H,1H3;1H
InChIKeyXNBCSVUOAUWNAN-UHFFFAOYSA-N
MW276.72 g/mol
LogP3.14
Rot. Bonds1

About 4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride

4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride (PubChem CID 24761099) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is 4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride.

Molecular Properties

Compound Name4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride
PubChem CID24761099
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC Name4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride
SMILESCc1ccn2cc(-c3ccc(O)c(O)c3)nc2c1.Cl
InChIInChI=1S/C14H12N2O2.ClH/c1-9-4-5-16-8-11(15-14(16)6-9)10-2-3-12(17)13(18)7-10;/h2-8,17-18H,1H3;1H
InChIKeyXNBCSVUOAUWNAN-UHFFFAOYSA-N
XLogP3.14
TPSA57.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

Analyze 4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride?
The IUPAC name of 4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride (CID 24761099) is 4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride.
What is the SMILES notation for 4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride?
The canonical SMILES for 4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride is Cc1ccn2cc(-c3ccc(O)c(O)c3)nc2c1.Cl.
What is the InChIKey of 4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride?
The InChIKey is XNBCSVUOAUWNAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2.ClH/c1-9-4-5-16-8-11(15-14(16)6-9)10-2-3-12(17)13(18)7-10;/h2-8,17-18H,1H3;1H.
What are the key properties of 4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride?
4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride has a molecular weight of 276.72 g/mol, XLogP of 3.14, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride is sourced from PubChem (CID 24761099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).