furan-3-yl-(2-propylpyrazol-3-yl)methanol

C11H14N2O2 — CID 63974629

IUPACfuran-3-yl-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1ccoc1
InChIInChI=1S/C11H14N2O2/c1-2-6-13-10(3-5-12-13)11(14)9-4-7-15-8-9/h3-5,7-8,11,14H,2,6H2,1H3
InChIKeyYJPQUFHCOOVMBQ-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.97
Rot. Bonds4

About furan-3-yl-(2-propylpyrazol-3-yl)methanol

furan-3-yl-(2-propylpyrazol-3-yl)methanol (PubChem CID 63974629) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is furan-3-yl-(2-propylpyrazol-3-yl)methanol.

Molecular Properties

Compound Namefuran-3-yl-(2-propylpyrazol-3-yl)methanol
PubChem CID63974629
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Namefuran-3-yl-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1ccoc1
InChIInChI=1S/C11H14N2O2/c1-2-6-13-10(3-5-12-13)11(14)9-4-7-15-8-9/h3-5,7-8,11,14H,2,6H2,1H3
InChIKeyYJPQUFHCOOVMBQ-UHFFFAOYSA-N
XLogP1.97
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of furan-3-yl-(2-propylpyrazol-3-yl)methanol?
The IUPAC name of furan-3-yl-(2-propylpyrazol-3-yl)methanol (CID 63974629) is furan-3-yl-(2-propylpyrazol-3-yl)methanol.
What is the SMILES notation for furan-3-yl-(2-propylpyrazol-3-yl)methanol?
The canonical SMILES for furan-3-yl-(2-propylpyrazol-3-yl)methanol is CCCn1nccc1C(O)c1ccoc1.
What is the InChIKey of furan-3-yl-(2-propylpyrazol-3-yl)methanol?
The InChIKey is YJPQUFHCOOVMBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-2-6-13-10(3-5-12-13)11(14)9-4-7-15-8-9/h3-5,7-8,11,14H,2,6H2,1H3.
What are the key properties of furan-3-yl-(2-propylpyrazol-3-yl)methanol?
furan-3-yl-(2-propylpyrazol-3-yl)methanol has a molecular weight of 206.25 g/mol, XLogP of 1.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-(2-propylpyrazol-3-yl)methanol is sourced from PubChem (CID 63974629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).