6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid

C11H11FN2O4 — CID 154069598

IUPAC6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid
SMILESCOCCOc1cc(F)cn2cc(C(=O)O)nc12
InChIInChI=1S/C11H11FN2O4/c1-17-2-3-18-9-4-7(12)5-14-6-8(11(15)16)13-10(9)14/h4-6H,2-3H2,1H3,(H,15,16)
InChIKeyOTWJWNZCTJFDJZ-UHFFFAOYSA-N
MW254.22 g/mol
LogP1.20
Rot. Bonds5

About 6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid

6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid (PubChem CID 154069598) has the molecular formula C11H11FN2O4 and a molecular weight of 254.22 g/mol. Its IUPAC name is 6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid
PubChem CID154069598
Molecular FormulaC11H11FN2O4
Molecular Weight254.22 g/mol
Exact Mass254.07
IUPAC Name6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid
SMILESCOCCOc1cc(F)cn2cc(C(=O)O)nc12
InChIInChI=1S/C11H11FN2O4/c1-17-2-3-18-9-4-7(12)5-14-6-8(11(15)16)13-10(9)14/h4-6H,2-3H2,1H3,(H,15,16)
InChIKeyOTWJWNZCTJFDJZ-UHFFFAOYSA-N
XLogP1.20
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.22
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid?
The IUPAC name of 6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid (CID 154069598) is 6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid?
The canonical SMILES for 6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid is COCCOc1cc(F)cn2cc(C(=O)O)nc12.
What is the InChIKey of 6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid?
The InChIKey is OTWJWNZCTJFDJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O4/c1-17-2-3-18-9-4-7(12)5-14-6-8(11(15)16)13-10(9)14/h4-6H,2-3H2,1H3,(H,15,16).
What are the key properties of 6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid?
6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid has a molecular weight of 254.22 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-8-(2-methoxyethoxy)imidazo[1,2-a]pyridine-2-carboxylic acid is sourced from PubChem (CID 154069598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).