3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride

C8H6ClFN2O2 — CID 53444491

IUPAC3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride
SMILESCl.O=C(O)c1nc2ccccn2c1F
InChIInChI=1S/C8H5FN2O2.ClH/c9-7-6(8(12)13)10-5-3-1-2-4-11(5)7;/h1-4H,(H,12,13);1H
InChIKeyKMWHBJFYCWHXDN-UHFFFAOYSA-N
MW216.60 g/mol
LogP1.59
Rot. Bonds1

About 3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride

3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride (PubChem CID 53444491) has the molecular formula C8H6ClFN2O2 and a molecular weight of 216.60 g/mol. Its IUPAC name is 3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride
PubChem CID53444491
Molecular FormulaC8H6ClFN2O2
Molecular Weight216.60 g/mol
Exact Mass216.01
IUPAC Name3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride
SMILESCl.O=C(O)c1nc2ccccn2c1F
InChIInChI=1S/C8H5FN2O2.ClH/c9-7-6(8(12)13)10-5-3-1-2-4-11(5)7;/h1-4H,(H,12,13);1H
InChIKeyKMWHBJFYCWHXDN-UHFFFAOYSA-N
XLogP1.59
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.60
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride?
The IUPAC name of 3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride (CID 53444491) is 3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride.
What is the SMILES notation for 3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride?
The canonical SMILES for 3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride is Cl.O=C(O)c1nc2ccccn2c1F.
What is the InChIKey of 3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride?
The InChIKey is KMWHBJFYCWHXDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FN2O2.ClH/c9-7-6(8(12)13)10-5-3-1-2-4-11(5)7;/h1-4H,(H,12,13);1H.
What are the key properties of 3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride?
3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride has a molecular weight of 216.60 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid;hydrochloride is sourced from PubChem (CID 53444491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).