[1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine

C14H13FN2OS — CID 105338710

IUPAC[1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine
SMILESNNC(Cc1ccsc1)c1cc2cc(F)ccc2o1
InChIInChI=1S/C14H13FN2OS/c15-11-1-2-13-10(6-11)7-14(18-13)12(17-16)5-9-3-4-19-8-9/h1-4,6-8,12,17H,5,16H2
InChIKeyMRTKWOMMWUWUSB-UHFFFAOYSA-N
MW276.34 g/mol
LogP3.38
Rot. Bonds4

About [1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine

[1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine (PubChem CID 105338710) has the molecular formula C14H13FN2OS and a molecular weight of 276.34 g/mol. Its IUPAC name is [1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine
PubChem CID105338710
Molecular FormulaC14H13FN2OS
Molecular Weight276.34 g/mol
Exact Mass276.07
IUPAC Name[1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine
SMILESNNC(Cc1ccsc1)c1cc2cc(F)ccc2o1
InChIInChI=1S/C14H13FN2OS/c15-11-1-2-13-10(6-11)7-14(18-13)12(17-16)5-9-3-4-19-8-9/h1-4,6-8,12,17H,5,16H2
InChIKeyMRTKWOMMWUWUSB-UHFFFAOYSA-N
XLogP3.38
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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)-2-thiophen-3-ylethyl]hydrazine?
The IUPAC name of [1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine (CID 105338710) is [1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine.
What is the SMILES notation for [1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine?
The canonical SMILES for [1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine is NNC(Cc1ccsc1)c1cc2cc(F)ccc2o1.
What is the InChIKey of [1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine?
The InChIKey is MRTKWOMMWUWUSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2OS/c15-11-1-2-13-10(6-11)7-14(18-13)12(17-16)5-9-3-4-19-8-9/h1-4,6-8,12,17H,5,16H2.
What are the key properties of [1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine?
[1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine has a molecular weight of 276.34 g/mol, XLogP of 3.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine is sourced from PubChem (CID 105338710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).