5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride

C12H8Cl2N2O2 — CID 45263932

IUPAC5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride
SMILESCl.O=C(O)c1cn2c(cc(Cl)c3ccccc32)n1
InChIInChI=1S/C12H7ClN2O2.ClH/c13-8-5-11-14-9(12(16)17)6-15(11)10-4-2-1-3-7(8)10;/h1-6H,(H,16,17);1H
InChIKeyDMDQMUZTCKAQOG-UHFFFAOYSA-N
MW283.11 g/mol
LogP3.26
Rot. Bonds1

About 5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride

5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride (PubChem CID 45263932) has the molecular formula C12H8Cl2N2O2 and a molecular weight of 283.11 g/mol. Its IUPAC name is 5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride
PubChem CID45263932
Molecular FormulaC12H8Cl2N2O2
Molecular Weight283.11 g/mol
Exact Mass282.00
IUPAC Name5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride
SMILESCl.O=C(O)c1cn2c(cc(Cl)c3ccccc32)n1
InChIInChI=1S/C12H7ClN2O2.ClH/c13-8-5-11-14-9(12(16)17)6-15(11)10-4-2-1-3-7(8)10;/h1-6H,(H,16,17);1H
InChIKeyDMDQMUZTCKAQOG-UHFFFAOYSA-N
XLogP3.26
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.11
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride?
The IUPAC name of 5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride (CID 45263932) is 5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride.
What is the SMILES notation for 5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride?
The canonical SMILES for 5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride is Cl.O=C(O)c1cn2c(cc(Cl)c3ccccc32)n1.
What is the InChIKey of 5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride?
The InChIKey is DMDQMUZTCKAQOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7ClN2O2.ClH/c13-8-5-11-14-9(12(16)17)6-15(11)10-4-2-1-3-7(8)10;/h1-6H,(H,16,17);1H.
What are the key properties of 5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride?
5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride has a molecular weight of 283.11 g/mol, XLogP of 3.26, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid;hydrochloride is sourced from PubChem (CID 45263932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).