4-(furan-2-yl)pyridine-3-carbaldehyde

C10H7NO2 — CID 96630721

IUPAC4-(furan-2-yl)pyridine-3-carbaldehyde
SMILESO=Cc1cnccc1-c1ccco1
InChIInChI=1S/C10H7NO2/c12-7-8-6-11-4-3-9(8)10-2-1-5-13-10/h1-7H
InChIKeyHACLDIHEWVJIPS-UHFFFAOYSA-N
MW173.17 g/mol
LogP2.15
Rot. Bonds2

About 4-(furan-2-yl)pyridine-3-carbaldehyde

4-(furan-2-yl)pyridine-3-carbaldehyde (PubChem CID 96630721) has the molecular formula C10H7NO2 and a molecular weight of 173.17 g/mol. Its IUPAC name is 4-(furan-2-yl)pyridine-3-carbaldehyde.

Molecular Properties

Compound Name4-(furan-2-yl)pyridine-3-carbaldehyde
PubChem CID96630721
Molecular FormulaC10H7NO2
Molecular Weight173.17 g/mol
Exact Mass173.05
IUPAC Name4-(furan-2-yl)pyridine-3-carbaldehyde
SMILESO=Cc1cnccc1-c1ccco1
InChIInChI=1S/C10H7NO2/c12-7-8-6-11-4-3-9(8)10-2-1-5-13-10/h1-7H
InChIKeyHACLDIHEWVJIPS-UHFFFAOYSA-N
XLogP2.15
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.17
LogP ≤ 52.15
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

3-(furan-2-yl)pyridine-4-carbaldehyde
CID 96630720
4-(4-methylphenyl)pyridine-3-carbaldehyde
CID 10878098
4-(2,3,4,5,6-pentafluorophenyl)pyridine-3-carbaldehyde
CID 118812839
4-(2,4,5-trichlorophenyl)pyridine-3-carbaldehyde
CID 134627378
4-(2-fluoro-4-methylphenyl)pyridine-3-carbaldehyde
CID 121367744
2-(furan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
CID 168528018
4-[4-(trifluoromethyl)phenyl]pyridine-3-carbaldehyde
CID 82382595
5,10-bis(furan-2-yl)benzo[g]isoquinoline
CID 59183652
3-(3-formyl-4-pyridinyl)benzonitrile
CID 59205208
5-[2-(furan-2-yl)phenyl]-1,3-oxazole
CID 168525054
4-(2-phenylmethoxyphenyl)pyridine-3-carbaldehyde
CID 13115153
4-[(4-ethylphenyl)methyl]pyridine-3-carbaldehyde
CID 96603971

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)pyridine-3-carbaldehyde?
The IUPAC name of 4-(furan-2-yl)pyridine-3-carbaldehyde (CID 96630721) is 4-(furan-2-yl)pyridine-3-carbaldehyde.
What is the SMILES notation for 4-(furan-2-yl)pyridine-3-carbaldehyde?
The canonical SMILES for 4-(furan-2-yl)pyridine-3-carbaldehyde is O=Cc1cnccc1-c1ccco1.
What is the InChIKey of 4-(furan-2-yl)pyridine-3-carbaldehyde?
The InChIKey is HACLDIHEWVJIPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7NO2/c12-7-8-6-11-4-3-9(8)10-2-1-5-13-10/h1-7H.
What are the key properties of 4-(furan-2-yl)pyridine-3-carbaldehyde?
4-(furan-2-yl)pyridine-3-carbaldehyde has a molecular weight of 173.17 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)pyridine-3-carbaldehyde is sourced from PubChem (CID 96630721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).