3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride

C15H13ClN2O2 — CID 52983714

IUPAC3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride
SMILESCc1c(-c2ccccc2)nc2c(C(=O)O)cccn12.Cl
InChIInChI=1S/C15H12N2O2.ClH/c1-10-13(11-6-3-2-4-7-11)16-14-12(15(18)19)8-5-9-17(10)14;/h2-9H,1H3,(H,18,19);1H
InChIKeyYSCCSRSSYVDMDI-UHFFFAOYSA-N
MW288.73 g/mol
LogP3.43
Rot. Bonds2

About 3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride

3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride (PubChem CID 52983714) has the molecular formula C15H13ClN2O2 and a molecular weight of 288.73 g/mol. Its IUPAC name is 3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride
PubChem CID52983714
Molecular FormulaC15H13ClN2O2
Molecular Weight288.73 g/mol
Exact Mass288.07
IUPAC Name3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride
SMILESCc1c(-c2ccccc2)nc2c(C(=O)O)cccn12.Cl
InChIInChI=1S/C15H12N2O2.ClH/c1-10-13(11-6-3-2-4-7-11)16-14-12(15(18)19)8-5-9-17(10)14;/h2-9H,1H3,(H,18,19);1H
InChIKeyYSCCSRSSYVDMDI-UHFFFAOYSA-N
XLogP3.43
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.73
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride?
The IUPAC name of 3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride (CID 52983714) is 3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride.
What is the SMILES notation for 3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride?
The canonical SMILES for 3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride is Cc1c(-c2ccccc2)nc2c(C(=O)O)cccn12.Cl.
What is the InChIKey of 3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride?
The InChIKey is YSCCSRSSYVDMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2.ClH/c1-10-13(11-6-3-2-4-7-11)16-14-12(15(18)19)8-5-9-17(10)14;/h2-9H,1H3,(H,18,19);1H.
What are the key properties of 3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride?
3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride has a molecular weight of 288.73 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride is sourced from PubChem (CID 52983714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).