3-chloro-6-(furan-2-yl)pyridazin-4-amine

C8H6ClN3O — CID 117127102

IUPAC3-chloro-6-(furan-2-yl)pyridazin-4-amine
SMILESNc1cc(-c2ccco2)nnc1Cl
InChIInChI=1S/C8H6ClN3O/c9-8-5(10)4-6(11-12-8)7-2-1-3-13-7/h1-4H,(H2,10,11)
InChIKeyMYEVKRKTKJKIFG-UHFFFAOYSA-N
MW195.61 g/mol
LogP1.97
Rot. Bonds1

About 3-chloro-6-(furan-2-yl)pyridazin-4-amine

3-chloro-6-(furan-2-yl)pyridazin-4-amine (PubChem CID 117127102) has the molecular formula C8H6ClN3O and a molecular weight of 195.61 g/mol. Its IUPAC name is 3-chloro-6-(furan-2-yl)pyridazin-4-amine.

Molecular Properties

Compound Name3-chloro-6-(furan-2-yl)pyridazin-4-amine
PubChem CID117127102
Molecular FormulaC8H6ClN3O
Molecular Weight195.61 g/mol
Exact Mass195.02
IUPAC Name3-chloro-6-(furan-2-yl)pyridazin-4-amine
SMILESNc1cc(-c2ccco2)nnc1Cl
InChIInChI=1S/C8H6ClN3O/c9-8-5(10)4-6(11-12-8)7-2-1-3-13-7/h1-4H,(H2,10,11)
InChIKeyMYEVKRKTKJKIFG-UHFFFAOYSA-N
XLogP1.97
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.61
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(furan-2-yl)pyridazin-4-amine?
The IUPAC name of 3-chloro-6-(furan-2-yl)pyridazin-4-amine (CID 117127102) is 3-chloro-6-(furan-2-yl)pyridazin-4-amine.
What is the SMILES notation for 3-chloro-6-(furan-2-yl)pyridazin-4-amine?
The canonical SMILES for 3-chloro-6-(furan-2-yl)pyridazin-4-amine is Nc1cc(-c2ccco2)nnc1Cl.
What is the InChIKey of 3-chloro-6-(furan-2-yl)pyridazin-4-amine?
The InChIKey is MYEVKRKTKJKIFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6ClN3O/c9-8-5(10)4-6(11-12-8)7-2-1-3-13-7/h1-4H,(H2,10,11).
What are the key properties of 3-chloro-6-(furan-2-yl)pyridazin-4-amine?
3-chloro-6-(furan-2-yl)pyridazin-4-amine has a molecular weight of 195.61 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(furan-2-yl)pyridazin-4-amine is sourced from PubChem (CID 117127102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).