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

C13H15BrN2S — CID 105200816

IUPAC[2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine
SMILESCc1cccc(C(Cc2sccc2Br)NN)c1
InChIInChI=1S/C13H15BrN2S/c1-9-3-2-4-10(7-9)12(16-15)8-13-11(14)5-6-17-13/h2-7,12,16H,8,15H2,1H3
InChIKeySGBNTVZEVAJBPT-UHFFFAOYSA-N
MW311.25 g/mol
LogP3.57
Rot. Bonds4

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

[2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine (PubChem CID 105200816) has the molecular formula C13H15BrN2S and a molecular weight of 311.25 g/mol. Its IUPAC name is [2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine
PubChem CID105200816
Molecular FormulaC13H15BrN2S
Molecular Weight311.25 g/mol
Exact Mass310.01
IUPAC Name[2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine
SMILESCc1cccc(C(Cc2sccc2Br)NN)c1
InChIInChI=1S/C13H15BrN2S/c1-9-3-2-4-10(7-9)12(16-15)8-13-11(14)5-6-17-13/h2-7,12,16H,8,15H2,1H3
InChIKeySGBNTVZEVAJBPT-UHFFFAOYSA-N
XLogP3.57
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.25
LogP ≤ 53.57
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-(3-bromothiophen-2-yl)-1-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105299572
3-(3-bromothiophen-2-yl)-2-(3-methylphenyl)propan-1-amine
CID 79416744
[2-(3-bromothiophen-2-yl)-1-(5-methylfuran-3-yl)ethyl]hydrazine
CID 105299564
[2-(3-bromothiophen-2-yl)-1-(2-fluoro-4-methylphenyl)ethyl]hydrazine
CID 105299497
[2-(4-bromophenyl)-1-(3-methylphenyl)ethyl]hydrazine
CID 105195534
[2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
CID 105299502
1,2-bis(3-bromothiophen-2-yl)ethylhydrazine
CID 105299585
[1-(3-bromo-2-chlorophenyl)-2-(3-bromothiophen-2-yl)ethyl]hydrazine
CID 105299590
2-[2-(3-bromothiophen-2-yl)-1-hydrazinylethyl]aniline
CID 105223929
[2-(3-bromothiophen-2-yl)-1-(2,3-dichlorophenyl)ethyl]hydrazine
CID 105299508
2-(3-bromothiophen-2-yl)-N-methyl-1-(4-methylphenyl)ethanamine
CID 62600319
[2-(3-bromothiophen-2-yl)-1-(3-chloro-4,5-dimethoxyphenyl)ethyl]hydrazine
CID 105204619

Frequently Asked Questions

What is the IUPAC name of [2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine?
The IUPAC name of [2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine (CID 105200816) is [2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine is Cc1cccc(C(Cc2sccc2Br)NN)c1.
What is the InChIKey of [2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine?
The InChIKey is SGBNTVZEVAJBPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN2S/c1-9-3-2-4-10(7-9)12(16-15)8-13-11(14)5-6-17-13/h2-7,12,16H,8,15H2,1H3.
What are the key properties of [2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine?
[2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine has a molecular weight of 311.25 g/mol, XLogP of 3.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105200816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).