[1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine

C8H13BrN2S2 — CID 105214014

IUPAC[1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine
SMILESCSCC(Cc1cc(Br)cs1)NN
InChIInChI=1S/C8H13BrN2S2/c1-12-5-7(11-10)3-8-2-6(9)4-13-8/h2,4,7,11H,3,5,10H2,1H3
InChIKeyMDTRKIXNZVMYPN-UHFFFAOYSA-N
MW281.24 g/mol
LogP2.25
Rot. Bonds5

About [1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine

[1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine (PubChem CID 105214014) has the molecular formula C8H13BrN2S2 and a molecular weight of 281.24 g/mol. Its IUPAC name is [1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine
PubChem CID105214014
Molecular FormulaC8H13BrN2S2
Molecular Weight281.24 g/mol
Exact Mass279.97
IUPAC Name[1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine
SMILESCSCC(Cc1cc(Br)cs1)NN
InChIInChI=1S/C8H13BrN2S2/c1-12-5-7(11-10)3-8-2-6(9)4-13-8/h2,4,7,11H,3,5,10H2,1H3
InChIKeyMDTRKIXNZVMYPN-UHFFFAOYSA-N
XLogP2.25
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.24
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(4-bromothiophen-2-yl)-3-ethylsulfanylpropan-2-yl]hydrazine
CID 105225472
1-(4-bromothiophen-2-yl)butan-2-ylhydrazine
CID 105201113
1-(4-bromothiophen-2-yl)-N-ethyl-3-methylsulfanylpropan-2-amine
CID 62691752
[1-(4-bromothiophen-2-yl)-3-methylsulfonylpropan-2-yl]hydrazine
CID 105299404
[1-(4-bromothiophen-2-yl)-5-methoxy-4-methylpentan-2-yl]hydrazine
CID 105299395
[1-(4-bromothiophen-2-yl)-3-cyclopentylpropan-2-yl]hydrazine
CID 105299335
[1-(4-bromothiophen-2-yl)-3-(4-chlorophenyl)propan-2-yl]hydrazine
CID 105197753
1-(4-bromothiophen-2-yl)-N-propylbutan-2-amine
CID 62601735
[1-(4-bromothiophen-2-yl)-3-ethyl-3-methoxypentan-2-yl]hydrazine
CID 105275510
4-bromo-2-[2-(4-bromothiophen-2-yl)-1-hydrazinylethyl]aniline
CID 105263590
1-(4-bromothiophen-2-yl)-3-ethyl-2-hydrazinyl-N,N-dimethylpentan-3-amine
CID 105241832
[1-(4-bromothiophen-2-yl)-4-pyridin-3-ylbutan-2-yl]hydrazine
CID 105299352

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine?
The IUPAC name of [1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine (CID 105214014) is [1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine.
What is the SMILES notation for [1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine?
The canonical SMILES for [1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine is CSCC(Cc1cc(Br)cs1)NN.
What is the InChIKey of [1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine?
The InChIKey is MDTRKIXNZVMYPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13BrN2S2/c1-12-5-7(11-10)3-8-2-6(9)4-13-8/h2,4,7,11H,3,5,10H2,1H3.
What are the key properties of [1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine?
[1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine has a molecular weight of 281.24 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine is sourced from PubChem (CID 105214014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).