4-aminoquinoline-2-carboxylic acid;hydrochloride

C10H9ClN2O2 — CID 171379335

IUPAC4-aminoquinoline-2-carboxylic acid;hydrochloride
SMILESCl.Nc1cc(C(=O)O)nc2ccccc12
InChIInChI=1S/C10H8N2O2.ClH/c11-7-5-9(10(13)14)12-8-4-2-1-3-6(7)8;/h1-5H,(H2,11,12)(H,13,14);1H
InChIKeyTWUFNUGPBAKGBN-UHFFFAOYSA-N
MW224.65 g/mol
LogP1.94
Rot. Bonds1

About 4-aminoquinoline-2-carboxylic acid;hydrochloride

4-aminoquinoline-2-carboxylic acid;hydrochloride (PubChem CID 171379335) has the molecular formula C10H9ClN2O2 and a molecular weight of 224.65 g/mol. Its IUPAC name is 4-aminoquinoline-2-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name4-aminoquinoline-2-carboxylic acid;hydrochloride
PubChem CID171379335
Molecular FormulaC10H9ClN2O2
Molecular Weight224.65 g/mol
Exact Mass224.04
IUPAC Name4-aminoquinoline-2-carboxylic acid;hydrochloride
SMILESCl.Nc1cc(C(=O)O)nc2ccccc12
InChIInChI=1S/C10H8N2O2.ClH/c11-7-5-9(10(13)14)12-8-4-2-1-3-6(7)8;/h1-5H,(H2,11,12)(H,13,14);1H
InChIKeyTWUFNUGPBAKGBN-UHFFFAOYSA-N
XLogP1.94
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.65
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-aminoquinoline-2-carboxylic acid;hydrochloride?
The IUPAC name of 4-aminoquinoline-2-carboxylic acid;hydrochloride (CID 171379335) is 4-aminoquinoline-2-carboxylic acid;hydrochloride.
What is the SMILES notation for 4-aminoquinoline-2-carboxylic acid;hydrochloride?
The canonical SMILES for 4-aminoquinoline-2-carboxylic acid;hydrochloride is Cl.Nc1cc(C(=O)O)nc2ccccc12.
What is the InChIKey of 4-aminoquinoline-2-carboxylic acid;hydrochloride?
The InChIKey is TWUFNUGPBAKGBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O2.ClH/c11-7-5-9(10(13)14)12-8-4-2-1-3-6(7)8;/h1-5H,(H2,11,12)(H,13,14);1H.
What are the key properties of 4-aminoquinoline-2-carboxylic acid;hydrochloride?
4-aminoquinoline-2-carboxylic acid;hydrochloride has a molecular weight of 224.65 g/mol, XLogP of 1.94, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-aminoquinoline-2-carboxylic acid;hydrochloride is sourced from PubChem (CID 171379335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).