5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde

C10H6FNO2 — CID 103840994

IUPAC5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde
SMILESO=Cc1ccc(-c2ccncc2F)o1
InChIInChI=1S/C10H6FNO2/c11-9-5-12-4-3-8(9)10-2-1-7(6-13)14-10/h1-6H
InChIKeyADJBIZZOBYIPEZ-UHFFFAOYSA-N
MW191.16 g/mol
LogP2.29
Rot. Bonds2

About 5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde

5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde (PubChem CID 103840994) has the molecular formula C10H6FNO2 and a molecular weight of 191.16 g/mol. Its IUPAC name is 5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde.

Molecular Properties

Compound Name5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde
PubChem CID103840994
Molecular FormulaC10H6FNO2
Molecular Weight191.16 g/mol
Exact Mass191.04
IUPAC Name5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde
SMILESO=Cc1ccc(-c2ccncc2F)o1
InChIInChI=1S/C10H6FNO2/c11-9-5-12-4-3-8(9)10-2-1-7(6-13)14-10/h1-6H
InChIKeyADJBIZZOBYIPEZ-UHFFFAOYSA-N
XLogP2.29
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-(4-methyl-3-pyridinyl)furan-2-carbaldehyde
CID 103840991
5-(4-methoxy-3-pyridinyl)furan-2-carbaldehyde
CID 130565682
5-(3-fluoro-2,4-dimethylphenyl)furan-2-carbaldehyde
CID 169335280
5-(2-fluoro-4-methylsulfonylphenyl)furan-2-carbaldehyde
CID 169332145
5-(2-fluoro-5-methylphenyl)furan-2-carbaldehyde
CID 43155826
5-(3-fluoro-2-pyridinyl)furan-2-carbaldehyde
CID 75524954
5-(2-bromo-3,5-difluorophenyl)furan-2-carbaldehyde
CID 169332004
5-(3-fluoro-4-pyridinyl)-1,2-oxazole-3-carboxylic acid
CID 131555755
5-[2-fluoro-4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]furan-2-carbaldehyde
CID 169334255
5-[2-(3,4-difluorophenyl)phenyl]furan-2-carbaldehyde
CID 169333066
3-fluoropyridine-4-carbaldehyde;hydrofluoride
CID 74891092
(E)-3-[5-(2-fluorophenyl)furan-2-yl]-1-pyridin-3-ylprop-2-en-1-one
CID 9185084

Frequently Asked Questions

What is the IUPAC name of 5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde?
The IUPAC name of 5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde (CID 103840994) is 5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde.
What is the SMILES notation for 5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde?
The canonical SMILES for 5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde is O=Cc1ccc(-c2ccncc2F)o1.
What is the InChIKey of 5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde?
The InChIKey is ADJBIZZOBYIPEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6FNO2/c11-9-5-12-4-3-8(9)10-2-1-7(6-13)14-10/h1-6H.
What are the key properties of 5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde?
5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde has a molecular weight of 191.16 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluoro-4-pyridinyl)furan-2-carbaldehyde is sourced from PubChem (CID 103840994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).