3-chloro-6-(furan-3-yl)pyridazine

C8H5ClN2O — CID 16733176

IUPAC3-chloro-6-(furan-3-yl)pyridazine
SMILESClc1ccc(-c2ccoc2)nn1
InChIInChI=1S/C8H5ClN2O/c9-8-2-1-7(10-11-8)6-3-4-12-5-6/h1-5H
InChIKeyQJKSDVBZKLOUSW-UHFFFAOYSA-N
MW180.59 g/mol
LogP2.39
Rot. Bonds1

About 3-chloro-6-(furan-3-yl)pyridazine

3-chloro-6-(furan-3-yl)pyridazine (PubChem CID 16733176) has the molecular formula C8H5ClN2O and a molecular weight of 180.59 g/mol. Its IUPAC name is 3-chloro-6-(furan-3-yl)pyridazine.

Molecular Properties

Compound Name3-chloro-6-(furan-3-yl)pyridazine
PubChem CID16733176
Molecular FormulaC8H5ClN2O
Molecular Weight180.59 g/mol
Exact Mass180.01
IUPAC Name3-chloro-6-(furan-3-yl)pyridazine
SMILESClc1ccc(-c2ccoc2)nn1
InChIInChI=1S/C8H5ClN2O/c9-8-2-1-7(10-11-8)6-3-4-12-5-6/h1-5H
InChIKeyQJKSDVBZKLOUSW-UHFFFAOYSA-N
XLogP2.39
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.59
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(furan-3-yl)pyridazine?
The IUPAC name of 3-chloro-6-(furan-3-yl)pyridazine (CID 16733176) is 3-chloro-6-(furan-3-yl)pyridazine.
What is the SMILES notation for 3-chloro-6-(furan-3-yl)pyridazine?
The canonical SMILES for 3-chloro-6-(furan-3-yl)pyridazine is Clc1ccc(-c2ccoc2)nn1.
What is the InChIKey of 3-chloro-6-(furan-3-yl)pyridazine?
The InChIKey is QJKSDVBZKLOUSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5ClN2O/c9-8-2-1-7(10-11-8)6-3-4-12-5-6/h1-5H.
What are the key properties of 3-chloro-6-(furan-3-yl)pyridazine?
3-chloro-6-(furan-3-yl)pyridazine has a molecular weight of 180.59 g/mol, XLogP of 2.39, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(furan-3-yl)pyridazine is sourced from PubChem (CID 16733176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).