3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde

C14H9FN2O2 — CID 175903594

IUPAC3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde
SMILESO=Cc1cccc(-c2cnc3ccc(F)cn23)c1O
InChIInChI=1S/C14H9FN2O2/c15-10-4-5-13-16-6-12(17(13)7-10)11-3-1-2-9(8-18)14(11)19/h1-8,19H
InChIKeyTYGQNAPNAGDFNI-UHFFFAOYSA-N
MW256.24 g/mol
LogP2.66
Rot. Bonds2

About 3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde

3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde (PubChem CID 175903594) has the molecular formula C14H9FN2O2 and a molecular weight of 256.24 g/mol. Its IUPAC name is 3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde.

Molecular Properties

Compound Name3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde
PubChem CID175903594
Molecular FormulaC14H9FN2O2
Molecular Weight256.24 g/mol
Exact Mass256.06
IUPAC Name3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde
SMILESO=Cc1cccc(-c2cnc3ccc(F)cn23)c1O
InChIInChI=1S/C14H9FN2O2/c15-10-4-5-13-16-6-12(17(13)7-10)11-3-1-2-9(8-18)14(11)19/h1-8,19H
InChIKeyTYGQNAPNAGDFNI-UHFFFAOYSA-N
XLogP2.66
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.24
LogP ≤ 52.66
H-Bond Donors ≤ 51
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 3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde?
The IUPAC name of 3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde (CID 175903594) is 3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde.
What is the SMILES notation for 3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde?
The canonical SMILES for 3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde is O=Cc1cccc(-c2cnc3ccc(F)cn23)c1O.
What is the InChIKey of 3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde?
The InChIKey is TYGQNAPNAGDFNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN2O2/c15-10-4-5-13-16-6-12(17(13)7-10)11-3-1-2-9(8-18)14(11)19/h1-8,19H.
What are the key properties of 3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde?
3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde has a molecular weight of 256.24 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde is sourced from PubChem (CID 175903594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).