6-amino-5-fluoropyridine-3-carbaldehyde

C6H5FN2O — CID 131028659

IUPAC6-amino-5-fluoropyridine-3-carbaldehyde
SMILESNc1ncc(C=O)cc1F
InChIInChI=1S/C6H5FN2O/c7-5-1-4(3-10)2-9-6(5)8/h1-3H,(H2,8,9)
InChIKeyBCYYWWAMWZVKLI-UHFFFAOYSA-N
MW140.12 g/mol
LogP0.62
Rot. Bonds1

About 6-amino-5-fluoropyridine-3-carbaldehyde

6-amino-5-fluoropyridine-3-carbaldehyde (PubChem CID 131028659) has the molecular formula C6H5FN2O and a molecular weight of 140.12 g/mol. Its IUPAC name is 6-amino-5-fluoropyridine-3-carbaldehyde.

Molecular Properties

Compound Name6-amino-5-fluoropyridine-3-carbaldehyde
PubChem CID131028659
Molecular FormulaC6H5FN2O
Molecular Weight140.12 g/mol
Exact Mass140.04
IUPAC Name6-amino-5-fluoropyridine-3-carbaldehyde
SMILESNc1ncc(C=O)cc1F
InChIInChI=1S/C6H5FN2O/c7-5-1-4(3-10)2-9-6(5)8/h1-3H,(H2,8,9)
InChIKeyBCYYWWAMWZVKLI-UHFFFAOYSA-N
XLogP0.62
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.12
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-amino-5-(2-fluorophenyl)pyridine-3-carbaldehyde
CID 87405121
6-bromo-5-fluoropyridine-3-carbaldehyde;ethane;methoxymethane
CID 177047075
5-fluoro-6-propan-2-yloxypyridine-3-carbaldehyde
CID 131547635
6-amino-5-[4-(trifluoromethyl)phenyl]pyridine-3-carbaldehyde
CID 87405942
2-aminopyrimidine-5-carbaldehyde;hydrate
CID 71464028
5,6-dichloropyridine-3-carbaldehyde
CID 11535654
6-(2,2-difluoro-2-phosphanylethoxy)-5-fluoropyridine-3-carbaldehyde
CID 138702850
5-methyl-6-(trifluoromethyl)pyridine-3-carbaldehyde
CID 58001739
5-fluoro-6-(2,3,5-trichlorophenyl)pyridine-3-carbaldehyde
CID 134637533
3-fluoro-5-(2-methylpropyl)pyridin-2-amine
CID 170761573
(6-amino-5-fluoro-3-pyridinyl)boronic acid
CID 91882688
5-ethynyl-3-fluoropyridin-2-amine
CID 74892202

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-fluoropyridine-3-carbaldehyde?
The IUPAC name of 6-amino-5-fluoropyridine-3-carbaldehyde (CID 131028659) is 6-amino-5-fluoropyridine-3-carbaldehyde.
What is the SMILES notation for 6-amino-5-fluoropyridine-3-carbaldehyde?
The canonical SMILES for 6-amino-5-fluoropyridine-3-carbaldehyde is Nc1ncc(C=O)cc1F.
What is the InChIKey of 6-amino-5-fluoropyridine-3-carbaldehyde?
The InChIKey is BCYYWWAMWZVKLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5FN2O/c7-5-1-4(3-10)2-9-6(5)8/h1-3H,(H2,8,9).
What are the key properties of 6-amino-5-fluoropyridine-3-carbaldehyde?
6-amino-5-fluoropyridine-3-carbaldehyde has a molecular weight of 140.12 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-fluoropyridine-3-carbaldehyde is sourced from PubChem (CID 131028659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).