[1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine

C12H12F2N2S — CID 105216666

IUPAC[1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine
SMILESNNC(Cc1ccsc1)c1ccc(F)cc1F
InChIInChI=1S/C12H12F2N2S/c13-9-1-2-10(11(14)6-9)12(16-15)5-8-3-4-17-7-8/h1-4,6-7,12,16H,5,15H2
InChIKeyXKHKBXMUGIPHAC-UHFFFAOYSA-N
MW254.31 g/mol
LogP2.77
Rot. Bonds4

About [1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine

[1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine (PubChem CID 105216666) has the molecular formula C12H12F2N2S and a molecular weight of 254.31 g/mol. Its IUPAC name is [1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine.

Molecular Properties

Compound Name[1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine
PubChem CID105216666
Molecular FormulaC12H12F2N2S
Molecular Weight254.31 g/mol
Exact Mass254.07
IUPAC Name[1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine
SMILESNNC(Cc1ccsc1)c1ccc(F)cc1F
InChIInChI=1S/C12H12F2N2S/c13-9-1-2-10(11(14)6-9)12(16-15)5-8-3-4-17-7-8/h1-4,6-7,12,16H,5,15H2
InChIKeyXKHKBXMUGIPHAC-UHFFFAOYSA-N
XLogP2.77
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 52.77
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-(2-bromo-4-fluorophenyl)-2-thiophen-3-ylethyl]hydrazine
CID 105297744
[1-(5-fluoro-1-benzofuran-2-yl)-2-thiophen-3-ylethyl]hydrazine
CID 105338710
[2-(3-bromo-4-fluorophenyl)-1-(2,4-difluorophenyl)ethyl]hydrazine
CID 105216503
[2-(4-chloro-3-fluorophenyl)-1-(2,4-difluorophenyl)ethyl]hydrazine
CID 107894963
[1-(5-fluoro-2-pyridinyl)-2-thiophen-3-ylethyl]hydrazine
CID 105248476
[2-thiophen-3-yl-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine
CID 105301456
1-(2,4-difluorophenyl)-3-thiophen-3-ylpropan-2-amine
CID 64559079
[2-(4-fluorophenyl)-1-thiophen-3-ylethyl]hydrazine
CID 105196708
N-[1-(4-fluoro-2-methylphenyl)-2-thiophen-3-ylethyl]propan-1-amine
CID 81276214
2-(2,4-difluorophenyl)-2-hydrazinyl-N,N-dimethylethanamine
CID 105244787
1-(4-chloro-2-fluorophenyl)-2-thiophen-3-ylethanamine
CID 61078640
3-(2,4-difluorophenyl)-N,N-diethyl-3-hydrazinylpropan-1-amine
CID 105244099

Frequently Asked Questions

What is the IUPAC name of [1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine?
The IUPAC name of [1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine (CID 105216666) is [1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine.
What is the SMILES notation for [1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine?
The canonical SMILES for [1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine is NNC(Cc1ccsc1)c1ccc(F)cc1F.
What is the InChIKey of [1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine?
The InChIKey is XKHKBXMUGIPHAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F2N2S/c13-9-1-2-10(11(14)6-9)12(16-15)5-8-3-4-17-7-8/h1-4,6-7,12,16H,5,15H2.
What are the key properties of [1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine?
[1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine has a molecular weight of 254.31 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,4-difluorophenyl)-2-thiophen-3-ylethyl]hydrazine is sourced from PubChem (CID 105216666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).