[1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine

C16H15FN2S — CID 105286405

IUPAC[1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1)c1csc2ccccc12
InChIInChI=1S/C16H15FN2S/c17-12-5-3-4-11(8-12)9-15(19-18)14-10-20-16-7-2-1-6-13(14)16/h1-8,10,15,19H,9,18H2
InChIKeyGODKNPQKWNXWML-UHFFFAOYSA-N
MW286.38 g/mol
LogP3.79
Rot. Bonds4

About [1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine

[1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine (PubChem CID 105286405) has the molecular formula C16H15FN2S and a molecular weight of 286.38 g/mol. Its IUPAC name is [1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine
PubChem CID105286405
Molecular FormulaC16H15FN2S
Molecular Weight286.38 g/mol
Exact Mass286.09
IUPAC Name[1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1)c1csc2ccccc12
InChIInChI=1S/C16H15FN2S/c17-12-5-3-4-11(8-12)9-15(19-18)14-10-20-16-7-2-1-6-13(14)16/h1-8,10,15,19H,9,18H2
InChIKeyGODKNPQKWNXWML-UHFFFAOYSA-N
XLogP3.79
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 53.79
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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Related Compounds

1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethanamine
CID 43150867
[1-(1-benzothiophen-3-yl)-2-(2-bromo-4-fluorophenyl)ethyl]hydrazine
CID 105296678
1-(1-benzothiophen-3-yl)-2-(3-chlorophenyl)-N-methylethanamine
CID 63507542
[2-(1-benzothiophen-3-yl)-1-(2-bromo-4-fluorophenyl)ethyl]hydrazine
CID 105291698
[1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291375
[1-(3-bromo-2-fluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 106648688
[1-(1-benzothiophen-3-yl)-3-methylbut-3-enyl]hydrazine
CID 105319578
[1-benzothiophen-3-yl-(2-chloro-5-fluorophenyl)methyl]hydrazine
CID 105398126
[1-(2,4-difluoro-5-methylphenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 105286436
[1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 105286398
1-(1-benzothiophen-3-yl)pent-4-ynylhydrazine
CID 105307898
[2-(1-benzothiophen-3-yl)-1-(2-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105291760

Frequently Asked Questions

What is the IUPAC name of [1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine (CID 105286405) is [1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine is NNC(Cc1cccc(F)c1)c1csc2ccccc12.
What is the InChIKey of [1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine?
The InChIKey is GODKNPQKWNXWML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2S/c17-12-5-3-4-11(8-12)9-15(19-18)14-10-20-16-7-2-1-6-13(14)16/h1-8,10,15,19H,9,18H2.
What are the key properties of [1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine?
[1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine has a molecular weight of 286.38 g/mol, XLogP of 3.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105286405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).