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

C13H14BrFN2S — CID 105377982

IUPAC[1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(F)cc1CC(NN)c1csc(Br)c1
InChIInChI=1S/C13H14BrFN2S/c1-8-2-3-11(15)4-9(8)5-12(17-16)10-6-13(14)18-7-10/h2-4,6-7,12,17H,5,16H2,1H3
InChIKeyQCDPGZGQXNOKPE-UHFFFAOYSA-N
MW329.24 g/mol
LogP3.71
Rot. Bonds4

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

[1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine (PubChem CID 105377982) has the molecular formula C13H14BrFN2S and a molecular weight of 329.24 g/mol. Its IUPAC name is [1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine
PubChem CID105377982
Molecular FormulaC13H14BrFN2S
Molecular Weight329.24 g/mol
Exact Mass328.00
IUPAC Name[1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(F)cc1CC(NN)c1csc(Br)c1
InChIInChI=1S/C13H14BrFN2S/c1-8-2-3-11(15)4-9(8)5-12(17-16)10-6-13(14)18-7-10/h2-4,6-7,12,17H,5,16H2,1H3
InChIKeyQCDPGZGQXNOKPE-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-(2-bromo-5-fluorophenyl)-1-(5-bromothiophen-3-yl)ethyl]hydrazine
CID 105297094
[1-(3,5-dimethylphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105378083
1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine
CID 105377773
[2-(2-bromo-5-fluorophenyl)-1-(5-iodothiophen-3-yl)ethyl]hydrazine
CID 105297096
4-bromo-2-[2-(5-fluoro-2-methylphenyl)-1-hydrazinylethyl]aniline
CID 105377915
[2-(5-fluoro-2-methylphenyl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine
CID 105377872
[2-(5-fluoro-2-methylphenyl)-1-(2,3,4-trifluorophenyl)ethyl]hydrazine
CID 105378026
[2-(2-bromo-5-fluorophenyl)-1-(3,5-difluorophenyl)ethyl]hydrazine
CID 105207928
(5-bromothiophen-3-yl)-(5-fluoro-2-methylphenyl)methanamine
CID 105142450
[2-(2-bromo-4-fluorophenyl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105204048
[1-(2,5-dibromothiophen-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 114022387
[1-(3-bromo-4-methoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105340895

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine (CID 105377982) is [1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine is Cc1ccc(F)cc1CC(NN)c1csc(Br)c1.
What is the InChIKey of [1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine?
The InChIKey is QCDPGZGQXNOKPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrFN2S/c1-8-2-3-11(15)4-9(8)5-12(17-16)10-6-13(14)18-7-10/h2-4,6-7,12,17H,5,16H2,1H3.
What are the key properties of [1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine?
[1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-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 [1-(5-bromothiophen-3-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105377982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).