[2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine

C13H14BrFN2S — CID 105203973

IUPAC[2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
SMILESCc1cc(C(Cc2ccc(Br)s2)NN)ccc1F
InChIInChI=1S/C13H14BrFN2S/c1-8-6-9(2-4-11(8)15)12(17-16)7-10-3-5-13(14)18-10/h2-6,12,17H,7,16H2,1H3
InChIKeyKHJRJBQFYMKCGB-UHFFFAOYSA-N
MW329.24 g/mol
LogP3.71
Rot. Bonds4

About [2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine

[2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine (PubChem CID 105203973) has the molecular formula C13H14BrFN2S and a molecular weight of 329.24 g/mol. Its IUPAC name is [2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
PubChem CID105203973
Molecular FormulaC13H14BrFN2S
Molecular Weight329.24 g/mol
Exact Mass328.00
IUPAC Name[2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
SMILESCc1cc(C(Cc2ccc(Br)s2)NN)ccc1F
InChIInChI=1S/C13H14BrFN2S/c1-8-6-9(2-4-11(8)15)12(17-16)7-10-3-5-13(14)18-10/h2-6,12,17H,7,16H2,1H3
InChIKeyKHJRJBQFYMKCGB-UHFFFAOYSA-N
XLogP3.71
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.24
LogP ≤ 53.71
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

[2-(5-bromothiophen-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine
CID 105192594
[2-(5-bromothiophen-2-yl)-1-(3-fluorophenyl)ethyl]hydrazine
CID 105192898
2-(5-bromothiophen-2-yl)-1-(3-fluoro-4-methylphenyl)-N-methylethanamine
CID 55095213
[2-(2-bromo-4-fluorophenyl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105204048
[2-(5-bromothiophen-2-yl)-1-(4-tert-butylphenyl)ethyl]hydrazine
CID 105295802
[2-(5-bromothiophen-2-yl)-1-(4-ethylphenyl)ethyl]hydrazine
CID 105197265
[(5-bromothiophen-2-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine
CID 105222042
[1-(3,4-difluorophenyl)-2-(5-ethylthiophen-2-yl)ethyl]hydrazine
CID 105197122
[2-(2,6-difluorophenyl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105204208
2-(5-bromothiophen-2-yl)-1-[4-fluoro-3-(trifluoromethyl)phenyl]-N-methylethanamine
CID 115841034
1-(4-fluoro-3-methylphenyl)butylhydrazine
CID 105202039
[1-(4-fluoro-3-methylphenyl)-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105204168

Frequently Asked Questions

What is the IUPAC name of [2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine?
The IUPAC name of [2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine (CID 105203973) is [2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine is Cc1cc(C(Cc2ccc(Br)s2)NN)ccc1F.
What is the InChIKey of [2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine?
The InChIKey is KHJRJBQFYMKCGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrFN2S/c1-8-6-9(2-4-11(8)15)12(17-16)7-10-3-5-13(14)18-10/h2-6,12,17H,7,16H2,1H3.
What are the key properties of [2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine?
[2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine has a molecular weight of 329.24 g/mol, XLogP of 3.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-bromothiophen-2-yl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105203973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).