6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid

C8H4Cl2N2O2 — CID 165459484

IUPAC6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid
SMILESO=C(O)c1cnc2cc(Cl)c(Cl)cn12
InChIInChI=1S/C8H4Cl2N2O2/c9-4-1-7-11-2-6(8(13)14)12(7)3-5(4)10/h1-3H,(H,13,14)
InChIKeyHOYYLIJAEYVUAL-UHFFFAOYSA-N
MW231.04 g/mol
LogP2.34
Rot. Bonds1

About 6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid

6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 165459484) has the molecular formula C8H4Cl2N2O2 and a molecular weight of 231.04 g/mol. Its IUPAC name is 6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid
PubChem CID165459484
Molecular FormulaC8H4Cl2N2O2
Molecular Weight231.04 g/mol
Exact Mass229.96
IUPAC Name6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid
SMILESO=C(O)c1cnc2cc(Cl)c(Cl)cn12
InChIInChI=1S/C8H4Cl2N2O2/c9-4-1-7-11-2-6(8(13)14)12(7)3-5(4)10/h1-3H,(H,13,14)
InChIKeyHOYYLIJAEYVUAL-UHFFFAOYSA-N
XLogP2.34
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.04
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid?
The IUPAC name of 6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid (CID 165459484) is 6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid?
The canonical SMILES for 6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid is O=C(O)c1cnc2cc(Cl)c(Cl)cn12.
What is the InChIKey of 6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid?
The InChIKey is HOYYLIJAEYVUAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4Cl2N2O2/c9-4-1-7-11-2-6(8(13)14)12(7)3-5(4)10/h1-3H,(H,13,14).
What are the key properties of 6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid?
6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 231.04 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dichloroimidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 165459484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).