4-(furan-2-yloxy)-1-methylpyrazole

C8H8N2O2 — CID 117233478

IUPAC4-(furan-2-yloxy)-1-methylpyrazole
SMILESCn1cc(Oc2ccco2)cn1
InChIInChI=1S/C8H8N2O2/c1-10-6-7(5-9-10)12-8-3-2-4-11-8/h2-6H,1H3
InChIKeyZPVRNKXMOOLFBB-UHFFFAOYSA-N
MW164.16 g/mol
LogP1.81
Rot. Bonds2

About 4-(furan-2-yloxy)-1-methylpyrazole

4-(furan-2-yloxy)-1-methylpyrazole (PubChem CID 117233478) has the molecular formula C8H8N2O2 and a molecular weight of 164.16 g/mol. Its IUPAC name is 4-(furan-2-yloxy)-1-methylpyrazole.

Molecular Properties

Compound Name4-(furan-2-yloxy)-1-methylpyrazole
PubChem CID117233478
Molecular FormulaC8H8N2O2
Molecular Weight164.16 g/mol
Exact Mass164.06
IUPAC Name4-(furan-2-yloxy)-1-methylpyrazole
SMILESCn1cc(Oc2ccco2)cn1
InChIInChI=1S/C8H8N2O2/c1-10-6-7(5-9-10)12-8-3-2-4-11-8/h2-6H,1H3
InChIKeyZPVRNKXMOOLFBB-UHFFFAOYSA-N
XLogP1.81
TPSA40.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yloxy)-1-methylpyrazole?
The IUPAC name of 4-(furan-2-yloxy)-1-methylpyrazole (CID 117233478) is 4-(furan-2-yloxy)-1-methylpyrazole.
What is the SMILES notation for 4-(furan-2-yloxy)-1-methylpyrazole?
The canonical SMILES for 4-(furan-2-yloxy)-1-methylpyrazole is Cn1cc(Oc2ccco2)cn1.
What is the InChIKey of 4-(furan-2-yloxy)-1-methylpyrazole?
The InChIKey is ZPVRNKXMOOLFBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2/c1-10-6-7(5-9-10)12-8-3-2-4-11-8/h2-6H,1H3.
What are the key properties of 4-(furan-2-yloxy)-1-methylpyrazole?
4-(furan-2-yloxy)-1-methylpyrazole has a molecular weight of 164.16 g/mol, XLogP of 1.81, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yloxy)-1-methylpyrazole is sourced from PubChem (CID 117233478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).