1-(5-chlorothiophen-2-yl)piperazine;hydrochloride

C8H12Cl2N2S — CID 167451866

IUPAC1-(5-chlorothiophen-2-yl)piperazine;hydrochloride
SMILESCl.Clc1ccc(N2CCNCC2)s1
InChIInChI=1S/C8H11ClN2S.ClH/c9-7-1-2-8(12-7)11-5-3-10-4-6-11;/h1-2,10H,3-6H2;1H
InChIKeyTZIVDFRIJYSTAC-UHFFFAOYSA-N
MW239.17 g/mol
LogP2.23
Rot. Bonds1

About 1-(5-chlorothiophen-2-yl)piperazine;hydrochloride

1-(5-chlorothiophen-2-yl)piperazine;hydrochloride (PubChem CID 167451866) has the molecular formula C8H12Cl2N2S and a molecular weight of 239.17 g/mol. Its IUPAC name is 1-(5-chlorothiophen-2-yl)piperazine;hydrochloride.

Molecular Properties

Compound Name1-(5-chlorothiophen-2-yl)piperazine;hydrochloride
PubChem CID167451866
Molecular FormulaC8H12Cl2N2S
Molecular Weight239.17 g/mol
Exact Mass238.01
IUPAC Name1-(5-chlorothiophen-2-yl)piperazine;hydrochloride
SMILESCl.Clc1ccc(N2CCNCC2)s1
InChIInChI=1S/C8H11ClN2S.ClH/c9-7-1-2-8(12-7)11-5-3-10-4-6-11;/h1-2,10H,3-6H2;1H
InChIKeyTZIVDFRIJYSTAC-UHFFFAOYSA-N
XLogP2.23
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.17
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-chlorothiophen-2-yl)piperazine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(Thiophen-2-yl)piperazine
CID 21950130
1-(5-Chlorothiophen-2-yl)-2-(trifluoromethyl)piperazine
CID 115101318
1-(5-Chlorothiophen-2-yl)-2-(trifluoromethyl)-1,4-diazepane
CID 115101703
1-(5-Chlorothiophen-2-yl)piperazine
CID 17912210
1-(2-Thienyl)piperazine hydrochloride
CID 23149811
5-chloro-N-methylthiophen-2-amine
CID 66829073
(3R)-1-(5-chlorothiophen-2-yl)-3-methylpiperazine
CID 67333182
5-chloro-N-ethyl-N-methylthiophen-2-amine
CID 67755029
N-(5-chlorothiophen-2-yl)piperazine-1-carboxamide
CID 69026880
1-(5-Chlorothiophen-2-yl)-3-methylpiperazine
CID 69379428
N'-(5-chlorothiophen-2-yl)ethane-1,2-diamine
CID 80279561
5-chloro-N-propan-2-ylthiophen-2-amine
CID 83529681

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorothiophen-2-yl)piperazine;hydrochloride?
The IUPAC name of 1-(5-chlorothiophen-2-yl)piperazine;hydrochloride (CID 167451866) is 1-(5-chlorothiophen-2-yl)piperazine;hydrochloride.
What is the SMILES notation for 1-(5-chlorothiophen-2-yl)piperazine;hydrochloride?
The canonical SMILES for 1-(5-chlorothiophen-2-yl)piperazine;hydrochloride is Cl.Clc1ccc(N2CCNCC2)s1.
What is the InChIKey of 1-(5-chlorothiophen-2-yl)piperazine;hydrochloride?
The InChIKey is TZIVDFRIJYSTAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClN2S.ClH/c9-7-1-2-8(12-7)11-5-3-10-4-6-11;/h1-2,10H,3-6H2;1H.
What are the key properties of 1-(5-chlorothiophen-2-yl)piperazine;hydrochloride?
1-(5-chlorothiophen-2-yl)piperazine;hydrochloride has a molecular weight of 239.17 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorothiophen-2-yl)piperazine;hydrochloride is sourced from PubChem (CID 167451866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).