1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine

C11H13FN2O — CID 105201183

IUPAC1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine
SMILESCCC(NN)c1cc2cc(F)ccc2o1
InChIInChI=1S/C11H13FN2O/c1-2-9(14-13)11-6-7-5-8(12)3-4-10(7)15-11/h3-6,9,14H,2,13H2,1H3
InChIKeyJWVHLRWALAWRGV-UHFFFAOYSA-N
MW208.24 g/mol
LogP2.49
Rot. Bonds3

About 1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine

1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine (PubChem CID 105201183) has the molecular formula C11H13FN2O and a molecular weight of 208.24 g/mol. Its IUPAC name is 1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine.

Molecular Properties

Compound Name1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine
PubChem CID105201183
Molecular FormulaC11H13FN2O
Molecular Weight208.24 g/mol
Exact Mass208.10
IUPAC Name1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine
SMILESCCC(NN)c1cc2cc(F)ccc2o1
InChIInChI=1S/C11H13FN2O/c1-2-9(14-13)11-6-7-5-8(12)3-4-10(7)15-11/h3-6,9,14H,2,13H2,1H3
InChIKeyJWVHLRWALAWRGV-UHFFFAOYSA-N
XLogP2.49
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine?
The IUPAC name of 1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine (CID 105201183) is 1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine.
What is the SMILES notation for 1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine?
The canonical SMILES for 1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine is CCC(NN)c1cc2cc(F)ccc2o1.
What is the InChIKey of 1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine?
The InChIKey is JWVHLRWALAWRGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O/c1-2-9(14-13)11-6-7-5-8(12)3-4-10(7)15-11/h3-6,9,14H,2,13H2,1H3.
What are the key properties of 1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine?
1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine has a molecular weight of 208.24 g/mol, XLogP of 2.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-1-benzofuran-2-yl)propylhydrazine is sourced from PubChem (CID 105201183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).