4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole

C11H14N2O2 — CID 116805242

IUPAC4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole
SMILESCC(C)n1cc(OCc2ccoc2)cn1
InChIInChI=1S/C11H14N2O2/c1-9(2)13-6-11(5-12-13)15-8-10-3-4-14-7-10/h3-7,9H,8H2,1-2H3
InChIKeyXOZUWTFTBJUAIC-UHFFFAOYSA-N
MW206.24 g/mol
LogP2.64
Rot. Bonds4

About 4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole

4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole (PubChem CID 116805242) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is 4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole.

Molecular Properties

Compound Name4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole
PubChem CID116805242
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC Name4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole
SMILESCC(C)n1cc(OCc2ccoc2)cn1
InChIInChI=1S/C11H14N2O2/c1-9(2)13-6-11(5-12-13)15-8-10-3-4-14-7-10/h3-7,9H,8H2,1-2H3
InChIKeyXOZUWTFTBJUAIC-UHFFFAOYSA-N
XLogP2.64
TPSA40.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole?
The IUPAC name of 4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole (CID 116805242) is 4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole.
What is the SMILES notation for 4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole?
The canonical SMILES for 4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole is CC(C)n1cc(OCc2ccoc2)cn1.
What is the InChIKey of 4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole?
The InChIKey is XOZUWTFTBJUAIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-9(2)13-6-11(5-12-13)15-8-10-3-4-14-7-10/h3-7,9H,8H2,1-2H3.
What are the key properties of 4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole?
4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole has a molecular weight of 206.24 g/mol, XLogP of 2.64, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-3-ylmethoxy)-1-propan-2-ylpyrazole is sourced from PubChem (CID 116805242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).