2-pyridazin-3-ylfuran-3-amine

C8H7N3O — CID 82415473

IUPAC2-pyridazin-3-ylfuran-3-amine
SMILESNc1ccoc1-c1cccnn1
InChIInChI=1S/C8H7N3O/c9-6-3-5-12-8(6)7-2-1-4-10-11-7/h1-5H,9H2
InChIKeyQGOXRJKJQNQKST-UHFFFAOYSA-N
MW161.16 g/mol
LogP1.32
Rot. Bonds1

About 2-pyridazin-3-ylfuran-3-amine

2-pyridazin-3-ylfuran-3-amine (PubChem CID 82415473) has the molecular formula C8H7N3O and a molecular weight of 161.16 g/mol. Its IUPAC name is 2-pyridazin-3-ylfuran-3-amine.

Molecular Properties

Compound Name2-pyridazin-3-ylfuran-3-amine
PubChem CID82415473
Molecular FormulaC8H7N3O
Molecular Weight161.16 g/mol
Exact Mass161.06
IUPAC Name2-pyridazin-3-ylfuran-3-amine
SMILESNc1ccoc1-c1cccnn1
InChIInChI=1S/C8H7N3O/c9-6-3-5-12-8(6)7-2-1-4-10-11-7/h1-5H,9H2
InChIKeyQGOXRJKJQNQKST-UHFFFAOYSA-N
XLogP1.32
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-pyridazin-3-ylfuran-3-amine?
The IUPAC name of 2-pyridazin-3-ylfuran-3-amine (CID 82415473) is 2-pyridazin-3-ylfuran-3-amine.
What is the SMILES notation for 2-pyridazin-3-ylfuran-3-amine?
The canonical SMILES for 2-pyridazin-3-ylfuran-3-amine is Nc1ccoc1-c1cccnn1.
What is the InChIKey of 2-pyridazin-3-ylfuran-3-amine?
The InChIKey is QGOXRJKJQNQKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O/c9-6-3-5-12-8(6)7-2-1-4-10-11-7/h1-5H,9H2.
What are the key properties of 2-pyridazin-3-ylfuran-3-amine?
2-pyridazin-3-ylfuran-3-amine has a molecular weight of 161.16 g/mol, XLogP of 1.32, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridazin-3-ylfuran-3-amine is sourced from PubChem (CID 82415473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).