[1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine

C16H14F2N2S — CID 105206637

IUPAC[1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1cc(F)cc(F)c1)c1cccc2ccsc12
InChIInChI=1S/C16H14F2N2S/c17-12-6-10(7-13(18)9-12)8-15(20-19)14-3-1-2-11-4-5-21-16(11)14/h1-7,9,15,20H,8,19H2
InChIKeyPTEIFVJATHRMFI-UHFFFAOYSA-N
MW304.37 g/mol
LogP3.93
Rot. Bonds4

About [1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine

[1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine (PubChem CID 105206637) has the molecular formula C16H14F2N2S and a molecular weight of 304.37 g/mol. Its IUPAC name is [1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine
PubChem CID105206637
Molecular FormulaC16H14F2N2S
Molecular Weight304.37 g/mol
Exact Mass304.08
IUPAC Name[1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1cc(F)cc(F)c1)c1cccc2ccsc12
InChIInChI=1S/C16H14F2N2S/c17-12-6-10(7-13(18)9-12)8-15(20-19)14-3-1-2-11-4-5-21-16(11)14/h1-7,9,15,20H,8,19H2
InChIKeyPTEIFVJATHRMFI-UHFFFAOYSA-N
XLogP3.93
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 53.93
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-7-yl)-2-(3,5-difluorophenyl)ethanol
CID 81152861
[1-(1-benzothiophen-7-yl)-2-(4-methylphenyl)ethyl]hydrazine
CID 105211276
[1-(1-benzothiophen-7-yl)-2-(2-fluorophenyl)ethyl]hydrazine
CID 105206873
[2-(3,5-difluorophenyl)-1-(2-methylthiophen-3-yl)ethyl]hydrazine
CID 102842693
[2-(3,5-difluorophenyl)-1-(2-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105413149
[1-benzothiophen-7-yl-(4-fluorophenyl)methyl]hydrazine
CID 105192643
[1-(1-benzothiophen-7-yl)-2-tert-butylsulfanylethyl]hydrazine
CID 105226376
[1-benzothiophen-7-yl-(2,3-difluorophenyl)methyl]hydrazine
CID 105327729
[1-(1-benzothiophen-7-yl)-2-propoxyethyl]hydrazine
CID 105209936
[1-(1-benzothiophen-7-yl)-2,2,2-trifluoroethyl]hydrazine
CID 105215616
[1-benzothiophen-7-yl-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105327623
[1-(1-benzothiophen-7-yl)-3-pyridin-3-ylpropyl]hydrazine
CID 105327733

Frequently Asked Questions

What is the IUPAC name of [1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine (CID 105206637) is [1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine is NNC(Cc1cc(F)cc(F)c1)c1cccc2ccsc12.
What is the InChIKey of [1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine?
The InChIKey is PTEIFVJATHRMFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2N2S/c17-12-6-10(7-13(18)9-12)8-15(20-19)14-3-1-2-11-4-5-21-16(11)14/h1-7,9,15,20H,8,19H2.
What are the key properties of [1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine?
[1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine has a molecular weight of 304.37 g/mol, XLogP of 3.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105206637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).