1-[2-(2-bromothiophen-3-yl)ethyl]piperazine

C10H15BrN2S — CID 82667485

IUPAC1-[2-(2-bromothiophen-3-yl)ethyl]piperazine
SMILESBrc1sccc1CCN1CCNCC1
InChIInChI=1S/C10H15BrN2S/c11-10-9(2-8-14-10)1-5-13-6-3-12-4-7-13/h2,8,12H,1,3-7H2
InChIKeySWDLNAOIZQPPFL-UHFFFAOYSA-N
MW275.21 g/mol
LogP1.96
Rot. Bonds3

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

1-[2-(2-bromothiophen-3-yl)ethyl]piperazine (PubChem CID 82667485) has the molecular formula C10H15BrN2S and a molecular weight of 275.21 g/mol. Its IUPAC name is 1-[2-(2-bromothiophen-3-yl)ethyl]piperazine.

Molecular Properties

Compound Name1-[2-(2-bromothiophen-3-yl)ethyl]piperazine
PubChem CID82667485
Molecular FormulaC10H15BrN2S
Molecular Weight275.21 g/mol
Exact Mass274.01
IUPAC Name1-[2-(2-bromothiophen-3-yl)ethyl]piperazine
SMILESBrc1sccc1CCN1CCNCC1
InChIInChI=1S/C10H15BrN2S/c11-10-9(2-8-14-10)1-5-13-6-3-12-4-7-13/h2,8,12H,1,3-7H2
InChIKeySWDLNAOIZQPPFL-UHFFFAOYSA-N
XLogP1.96
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.21
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(3-bromo-4-pyridinyl)ethyl]piperazine
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5-bromo-3-(2-piperazin-1-ylethyl)-1H-indole
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1-[2-(2-chlorothiophen-3-yl)ethyl]pyrrolidine
CID 57428859
1-[2-(5-bromo-2-methylfuran-3-yl)ethyl]piperazine
CID 82667448
3-bromo-7-(2-piperazin-1-ylethyl)-1H-indole
CID 117493145
1-[2-(2-propan-2-ylphenyl)ethyl]piperazine
CID 96808954
1-[2-(3-bromophenyl)ethyl]piperazine
CID 53407154
1-[2-[2-(pyrrolidin-1-ylmethyl)phenyl]ethyl]piperazine
CID 117436770
1-[2-(5-bromo-2-ethoxyphenyl)ethyl]piperazine
CID 82263455
bis(1-(2-phenylethyl)piperazine);dihydrochloride
CID 102602644
1-[2-(2-methoxyphenyl)ethyl]piperazine;dihydrochloride
CID 52983547
1-[2-(4-bromo-3-methylphenyl)ethyl]piperazine
CID 82264462

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-bromothiophen-3-yl)ethyl]piperazine?
The IUPAC name of 1-[2-(2-bromothiophen-3-yl)ethyl]piperazine (CID 82667485) is 1-[2-(2-bromothiophen-3-yl)ethyl]piperazine.
What is the SMILES notation for 1-[2-(2-bromothiophen-3-yl)ethyl]piperazine?
The canonical SMILES for 1-[2-(2-bromothiophen-3-yl)ethyl]piperazine is Brc1sccc1CCN1CCNCC1.
What is the InChIKey of 1-[2-(2-bromothiophen-3-yl)ethyl]piperazine?
The InChIKey is SWDLNAOIZQPPFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN2S/c11-10-9(2-8-14-10)1-5-13-6-3-12-4-7-13/h2,8,12H,1,3-7H2.
What are the key properties of 1-[2-(2-bromothiophen-3-yl)ethyl]piperazine?
1-[2-(2-bromothiophen-3-yl)ethyl]piperazine has a molecular weight of 275.21 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-bromothiophen-3-yl)ethyl]piperazine is sourced from PubChem (CID 82667485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).