3-(furan-3-yl)-5-phenyl-1H-pyrazole

C13H10N2O — CID 71259843

IUPAC3-(furan-3-yl)-5-phenyl-1H-pyrazole
SMILESc1ccc(-c2cc(-c3ccoc3)n[nH]2)cc1
InChIInChI=1S/C13H10N2O/c1-2-4-10(5-3-1)12-8-13(15-14-12)11-6-7-16-9-11/h1-9H,(H,14,15)
InChIKeyYIJPBHUFHDWHOA-UHFFFAOYSA-N
MW210.24 g/mol
LogP3.34
Rot. Bonds2

About 3-(furan-3-yl)-5-phenyl-1H-pyrazole

3-(furan-3-yl)-5-phenyl-1H-pyrazole (PubChem CID 71259843) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 3-(furan-3-yl)-5-phenyl-1H-pyrazole.

Molecular Properties

Compound Name3-(furan-3-yl)-5-phenyl-1H-pyrazole
PubChem CID71259843
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name3-(furan-3-yl)-5-phenyl-1H-pyrazole
SMILESc1ccc(-c2cc(-c3ccoc3)n[nH]2)cc1
InChIInChI=1S/C13H10N2O/c1-2-4-10(5-3-1)12-8-13(15-14-12)11-6-7-16-9-11/h1-9H,(H,14,15)
InChIKeyYIJPBHUFHDWHOA-UHFFFAOYSA-N
XLogP3.34
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-3-yl)-5-phenyl-1H-pyrazole?
The IUPAC name of 3-(furan-3-yl)-5-phenyl-1H-pyrazole (CID 71259843) is 3-(furan-3-yl)-5-phenyl-1H-pyrazole.
What is the SMILES notation for 3-(furan-3-yl)-5-phenyl-1H-pyrazole?
The canonical SMILES for 3-(furan-3-yl)-5-phenyl-1H-pyrazole is c1ccc(-c2cc(-c3ccoc3)n[nH]2)cc1.
What is the InChIKey of 3-(furan-3-yl)-5-phenyl-1H-pyrazole?
The InChIKey is YIJPBHUFHDWHOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O/c1-2-4-10(5-3-1)12-8-13(15-14-12)11-6-7-16-9-11/h1-9H,(H,14,15).
What are the key properties of 3-(furan-3-yl)-5-phenyl-1H-pyrazole?
3-(furan-3-yl)-5-phenyl-1H-pyrazole has a molecular weight of 210.24 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-3-yl)-5-phenyl-1H-pyrazole is sourced from PubChem (CID 71259843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).