4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine

C13H9N5 — CID 54320064

IUPAC4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine
SMILESc1ccc(-c2cnncc2-c2ncccn2)nc1
InChIInChI=1S/C13H9N5/c1-2-5-14-12(4-1)10-8-17-18-9-11(10)13-15-6-3-7-16-13/h1-9H
InChIKeyQYTIDSDXQICIHG-UHFFFAOYSA-N
MW235.25 g/mol
LogP2.00
Rot. Bonds2

About 4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine

4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine (PubChem CID 54320064) has the molecular formula C13H9N5 and a molecular weight of 235.25 g/mol. Its IUPAC name is 4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine.

Molecular Properties

Compound Name4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine
PubChem CID54320064
Molecular FormulaC13H9N5
Molecular Weight235.25 g/mol
Exact Mass235.09
IUPAC Name4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine
SMILESc1ccc(-c2cnncc2-c2ncccn2)nc1
InChIInChI=1S/C13H9N5/c1-2-5-14-12(4-1)10-8-17-18-9-11(10)13-15-6-3-7-16-13/h1-9H
InChIKeyQYTIDSDXQICIHG-UHFFFAOYSA-N
XLogP2.00
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

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bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
cesium 2,6-dipyridin-2-ylphenolate
CID 59522981
4-[3,5-bis(2,5-dipyridin-2-yl-4-pyridinyl)phenyl]-2,5-dipyridin-2-ylpyridine
CID 102352668
2-(3-pyridin-2-yl-1H-pyrrol-2-yl)pyrimidine
CID 141043222

Frequently Asked Questions

What is the IUPAC name of 4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine?
The IUPAC name of 4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine (CID 54320064) is 4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine.
What is the SMILES notation for 4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine?
The canonical SMILES for 4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine is c1ccc(-c2cnncc2-c2ncccn2)nc1.
What is the InChIKey of 4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine?
The InChIKey is QYTIDSDXQICIHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N5/c1-2-5-14-12(4-1)10-8-17-18-9-11(10)13-15-6-3-7-16-13/h1-9H.
What are the key properties of 4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine?
4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine has a molecular weight of 235.25 g/mol, XLogP of 2.00, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine is sourced from PubChem (CID 54320064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).