6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde

C13H8FN3O — CID 86670604

IUPAC6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1cnc2ccc(-c3cncc(F)c3)cn12
InChIInChI=1S/C13H8FN3O/c14-11-3-10(4-15-5-11)9-1-2-13-16-6-12(8-18)17(13)7-9/h1-8H
InChIKeyHRUHWXAORACVAH-UHFFFAOYSA-N
MW241.23 g/mol
LogP2.35
Rot. Bonds2

About 6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde

6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 86670604) has the molecular formula C13H8FN3O and a molecular weight of 241.23 g/mol. Its IUPAC name is 6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID86670604
Molecular FormulaC13H8FN3O
Molecular Weight241.23 g/mol
Exact Mass241.07
IUPAC Name6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1cnc2ccc(-c3cncc(F)c3)cn12
InChIInChI=1S/C13H8FN3O/c14-11-3-10(4-15-5-11)9-1-2-13-16-6-12(8-18)17(13)7-9/h1-8H
InChIKeyHRUHWXAORACVAH-UHFFFAOYSA-N
XLogP2.35
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.23
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde (CID 86670604) is 6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde is O=Cc1cnc2ccc(-c3cncc(F)c3)cn12.
What is the InChIKey of 6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is HRUHWXAORACVAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8FN3O/c14-11-3-10(4-15-5-11)9-1-2-13-16-6-12(8-18)17(13)7-9/h1-8H.
What are the key properties of 6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde?
6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 241.23 g/mol, XLogP of 2.35, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 86670604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).