5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine

C17H11N5O — CID 141360425

IUPAC5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine
SMILESc1ccc(-c2nc(-c3cccnn3)ncc2-c2ccco2)nc1
InChIInChI=1S/C17H11N5O/c1-2-8-18-13(5-1)16-12(15-7-4-10-23-15)11-19-17(21-16)14-6-3-9-20-22-14/h1-11H
InChIKeyKKQGQAKMWARNFT-UHFFFAOYSA-N
MW301.31 g/mol
LogP3.26
Rot. Bonds3

About 5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine

5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine (PubChem CID 141360425) has the molecular formula C17H11N5O and a molecular weight of 301.31 g/mol. Its IUPAC name is 5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine.

Molecular Properties

Compound Name5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine
PubChem CID141360425
Molecular FormulaC17H11N5O
Molecular Weight301.31 g/mol
Exact Mass301.10
IUPAC Name5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine
SMILESc1ccc(-c2nc(-c3cccnn3)ncc2-c2ccco2)nc1
InChIInChI=1S/C17H11N5O/c1-2-8-18-13(5-1)16-12(15-7-4-10-23-15)11-19-17(21-16)14-6-3-9-20-22-14/h1-11H
InChIKeyKKQGQAKMWARNFT-UHFFFAOYSA-N
XLogP3.26
TPSA77.59 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.31
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

3-(furan-2-yl)-2-pyridin-2-ylpyridine
CID 121395467
2-[2-(furan-2-yl)phenyl]pyridine
CID 168525808
4-(furan-2-yl)-2,6-dipyridin-2-ylpyridine
CID 11434639
3-pyridazin-3-yl-4-pyridin-2-ylpyridazine
CID 68868230
4-bromo-2-pyridazin-3-ylpyrimidine
CID 19050405
2-(furan-2-yl)pyrido[3,2-d]pyrimidine
CID 101478815
4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine
CID 23144699
3-(furan-2-yl)-1,2,4-triazine
CID 11367075
5-pyrazin-2-yl-2-pyridin-2-yl-4-pyridin-3-ylpyrimidine
CID 4604268
2-(furan-2-yl)-7-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 56923224
4-(furan-2-yl)-2-phenylpyrimidine-5-carbonitrile
CID 24901796
4-(furan-2-yl)-2-pyridin-2-yl-6-pyridin-4-ylpyridine
CID 101132495

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine?
The IUPAC name of 5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine (CID 141360425) is 5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine.
What is the SMILES notation for 5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine?
The canonical SMILES for 5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine is c1ccc(-c2nc(-c3cccnn3)ncc2-c2ccco2)nc1.
What is the InChIKey of 5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine?
The InChIKey is KKQGQAKMWARNFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N5O/c1-2-8-18-13(5-1)16-12(15-7-4-10-23-15)11-19-17(21-16)14-6-3-9-20-22-14/h1-11H.
What are the key properties of 5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine?
5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine has a molecular weight of 301.31 g/mol, XLogP of 3.26, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-2-pyridazin-3-yl-4-pyridin-2-ylpyrimidine is sourced from PubChem (CID 141360425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).