pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde

C19H16N2O — CID 87992660

IUPACpyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde
SMILESO=Cc1ccc(C=Cc2ccncc2)cc1.c1ccncc1
InChIInChI=1S/C14H11NO.C5H5N/c16-11-14-5-3-12(4-6-14)1-2-13-7-9-15-10-8-13;1-2-4-6-5-3-1/h1-11H;1-5H
InChIKeyQDLOFWNHLBYYIR-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.15
Rot. Bonds3

About pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde

pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde (PubChem CID 87992660) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde.

Molecular Properties

Compound Namepyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde
PubChem CID87992660
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Namepyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde
SMILESO=Cc1ccc(C=Cc2ccncc2)cc1.c1ccncc1
InChIInChI=1S/C14H11NO.C5H5N/c16-11-14-5-3-12(4-6-14)1-2-13-7-9-15-10-8-13;1-2-4-6-5-3-1/h1-11H;1-5H
InChIKeyQDLOFWNHLBYYIR-UHFFFAOYSA-N
XLogP4.15
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.15
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

benzaldehyde;bis(pyridine)
CID 174954830
4-(2-phenylethenyl)pyridine;hydrochloride
CID 71352999
benzene;terephthalaldehyde
CID 163498156
propane;pyridine-4-carbaldehyde
CID 144763024
4-[2-(2-pyridin-2-yl-4-pyridinyl)ethenyl]benzaldehyde
CID 54562489
N-phenyl-4-[(E)-2-[4-[(E)-2-pyridin-4-ylethenyl]phenyl]ethenyl]-N-[4-[(E)-2-[4-[(E)-2-pyridin-4-ylethenyl]phenyl]ethenyl]phenyl]aniline
CID 101360915
4-[(E)-2-[4-(1,2,2-triphenylethenyl)phenyl]ethenyl]pyridine
CID 102493364
4-(4-phenylbuta-1,3-dienyl)benzaldehyde
CID 71360938
(Z)-3-pyridin-4-ylprop-2-enal
CID 99864035
4-[(E)-2-pyridin-4-ylethenyl]benzenethiol
CID 142469132
N-ethylethanamine;4-(2-phenylethenyl)pyridine
CID 67628430
tris[4-[(E)-2-pyridin-4-ylethenyl]phenyl]phosphane
CID 58942141

Frequently Asked Questions

What is the IUPAC name of pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde?
The IUPAC name of pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde (CID 87992660) is pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde.
What is the SMILES notation for pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde?
The canonical SMILES for pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde is O=Cc1ccc(C=Cc2ccncc2)cc1.c1ccncc1.
What is the InChIKey of pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde?
The InChIKey is QDLOFWNHLBYYIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO.C5H5N/c16-11-14-5-3-12(4-6-14)1-2-13-7-9-15-10-8-13;1-2-4-6-5-3-1/h1-11H;1-5H.
What are the key properties of pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde?
pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde has a molecular weight of 288.35 g/mol, XLogP of 4.15, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyridine;4-(2-pyridin-4-ylethenyl)benzaldehyde is sourced from PubChem (CID 87992660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).