3-pyridin-3-ylfuran-2-carbaldehyde

C10H7NO2 — CID 106886416

IUPAC3-pyridin-3-ylfuran-2-carbaldehyde
SMILESO=Cc1occc1-c1cccnc1
InChIInChI=1S/C10H7NO2/c12-7-10-9(3-5-13-10)8-2-1-4-11-6-8/h1-7H
InChIKeyAKPGITTZFRBINL-UHFFFAOYSA-N
MW173.17 g/mol
LogP2.15
Rot. Bonds2

About 3-pyridin-3-ylfuran-2-carbaldehyde

3-pyridin-3-ylfuran-2-carbaldehyde (PubChem CID 106886416) has the molecular formula C10H7NO2 and a molecular weight of 173.17 g/mol. Its IUPAC name is 3-pyridin-3-ylfuran-2-carbaldehyde.

Molecular Properties

Compound Name3-pyridin-3-ylfuran-2-carbaldehyde
PubChem CID106886416
Molecular FormulaC10H7NO2
Molecular Weight173.17 g/mol
Exact Mass173.05
IUPAC Name3-pyridin-3-ylfuran-2-carbaldehyde
SMILESO=Cc1occc1-c1cccnc1
InChIInChI=1S/C10H7NO2/c12-7-10-9(3-5-13-10)8-2-1-4-11-6-8/h1-7H
InChIKeyAKPGITTZFRBINL-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'}

Analyze 3-pyridin-3-ylfuran-2-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(5-methoxy-3-pyridinyl)furan-2-carbaldehyde
CID 106886591
3-pyridin-3-ylfuran-2-carbohydrazide
CID 70805892
2-pyridin-3-yl-1,3-oxazole-4-carbaldehyde
CID 115083655
3-[4-(N-phenylanilino)phenyl]furan-2-carbaldehyde
CID 151991885
5-pyridin-3-yl-1,3,4-oxadiazole-2-carbaldehyde
CID 21031007
5-pyridin-3-yl-1,2-oxazole-4-carbaldehyde
CID 82411534
4-(2-formylfuran-3-yl)benzonitrile
CID 154368989
methyl (E)-3-(2-pyridin-3-ylfuran-3-yl)prop-2-enoate
CID 102206090
3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine
CID 169050404
3-(2-methylpyrazol-3-yl)furan-2-carbaldehyde
CID 106886490
3-(3,4-diethylphenyl)furan-2-carbaldehyde
CID 106888488
3-(4-pyridin-3-ylthiophen-3-yl)pyridine
CID 46316707

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-3-ylfuran-2-carbaldehyde?
The IUPAC name of 3-pyridin-3-ylfuran-2-carbaldehyde (CID 106886416) is 3-pyridin-3-ylfuran-2-carbaldehyde.
What is the SMILES notation for 3-pyridin-3-ylfuran-2-carbaldehyde?
The canonical SMILES for 3-pyridin-3-ylfuran-2-carbaldehyde is O=Cc1occc1-c1cccnc1.
What is the InChIKey of 3-pyridin-3-ylfuran-2-carbaldehyde?
The InChIKey is AKPGITTZFRBINL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7NO2/c12-7-10-9(3-5-13-10)8-2-1-4-11-6-8/h1-7H.
What are the key properties of 3-pyridin-3-ylfuran-2-carbaldehyde?
3-pyridin-3-ylfuran-2-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 3-pyridin-3-ylfuran-2-carbaldehyde is sourced from PubChem (CID 106886416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).