2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde

C11H7FN2O — CID 131869660

IUPAC2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde
SMILESO=Cc1ccc(-c2ccncc2)nc1F
InChIInChI=1S/C11H7FN2O/c12-11-9(7-15)1-2-10(14-11)8-3-5-13-6-4-8/h1-7H
InChIKeyBMVFBKBHJFYWJJ-UHFFFAOYSA-N
MW202.19 g/mol
LogP2.10
Rot. Bonds2

About 2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde

2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde (PubChem CID 131869660) has the molecular formula C11H7FN2O and a molecular weight of 202.19 g/mol. Its IUPAC name is 2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde.

Molecular Properties

Compound Name2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde
PubChem CID131869660
Molecular FormulaC11H7FN2O
Molecular Weight202.19 g/mol
Exact Mass202.05
IUPAC Name2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde
SMILESO=Cc1ccc(-c2ccncc2)nc1F
InChIInChI=1S/C11H7FN2O/c12-11-9(7-15)1-2-10(14-11)8-3-5-13-6-4-8/h1-7H
InChIKeyBMVFBKBHJFYWJJ-UHFFFAOYSA-N
XLogP2.10
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.19
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-fluoro-6-pyridin-3-ylpyridine-3-carbaldehyde
CID 131869800
2-fluoro-6-(3,4,5-trichlorophenyl)pyridine-3-carbaldehyde
CID 133090274
2-fluoro-6-(2,4,6-trichlorophenyl)pyridine-3-carbaldehyde
CID 133090273
6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde
CID 133090737
2,5-dipyridin-4-ylpyridine-4-carbaldehyde
CID 131870499
3-pyridin-4-ylpyridine-4-carbaldehyde
CID 46316056
6-phenyl-2-propan-2-ylpyridine-3-carbaldehyde
CID 12886374
2-fluoroquinoline-3-carbaldehyde
CID 15357643
3-fluoropyridine-4-carbaldehyde;hydrofluoride
CID 74891092
2-methoxy-4-pyridin-4-ylbenzaldehyde
CID 164891675
4-pyridin-4-ylpyridine;bis(trifluoroborane)
CID 14319291
(3-(18F)fluoro-4-formylphenyl)methyl-tripyridin-4-ylphosphanium
CID 24888157

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde?
The IUPAC name of 2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde (CID 131869660) is 2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde.
What is the SMILES notation for 2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde?
The canonical SMILES for 2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde is O=Cc1ccc(-c2ccncc2)nc1F.
What is the InChIKey of 2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde?
The InChIKey is BMVFBKBHJFYWJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7FN2O/c12-11-9(7-15)1-2-10(14-11)8-3-5-13-6-4-8/h1-7H.
What are the key properties of 2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde?
2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde has a molecular weight of 202.19 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde is sourced from PubChem (CID 131869660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).