1-(5-ethylthiophen-3-yl)piperazine

C10H16N2S — CID 57230247

IUPAC1-(5-ethylthiophen-3-yl)piperazine
SMILESCCc1cc(N2CCNCC2)cs1
InChIInChI=1S/C10H16N2S/c1-2-10-7-9(8-13-10)12-5-3-11-4-6-12/h7-8,11H,2-6H2,1H3
InChIKeyUPADBLCGCMHPNY-UHFFFAOYSA-N
MW196.32 g/mol
LogP1.72
Rot. Bonds2

About 1-(5-ethylthiophen-3-yl)piperazine

1-(5-ethylthiophen-3-yl)piperazine (PubChem CID 57230247) has the molecular formula C10H16N2S and a molecular weight of 196.32 g/mol. Its IUPAC name is 1-(5-ethylthiophen-3-yl)piperazine.

Molecular Properties

Compound Name1-(5-ethylthiophen-3-yl)piperazine
PubChem CID57230247
Molecular FormulaC10H16N2S
Molecular Weight196.32 g/mol
Exact Mass196.10
IUPAC Name1-(5-ethylthiophen-3-yl)piperazine
SMILESCCc1cc(N2CCNCC2)cs1
InChIInChI=1S/C10H16N2S/c1-2-10-7-9(8-13-10)12-5-3-11-4-6-12/h7-8,11H,2-6H2,1H3
InChIKeyUPADBLCGCMHPNY-UHFFFAOYSA-N
XLogP1.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylthiophen-3-yl)piperazine?
The IUPAC name of 1-(5-ethylthiophen-3-yl)piperazine (CID 57230247) is 1-(5-ethylthiophen-3-yl)piperazine.
What is the SMILES notation for 1-(5-ethylthiophen-3-yl)piperazine?
The canonical SMILES for 1-(5-ethylthiophen-3-yl)piperazine is CCc1cc(N2CCNCC2)cs1.
What is the InChIKey of 1-(5-ethylthiophen-3-yl)piperazine?
The InChIKey is UPADBLCGCMHPNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2S/c1-2-10-7-9(8-13-10)12-5-3-11-4-6-12/h7-8,11H,2-6H2,1H3.
What are the key properties of 1-(5-ethylthiophen-3-yl)piperazine?
1-(5-ethylthiophen-3-yl)piperazine has a molecular weight of 196.32 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylthiophen-3-yl)piperazine is sourced from PubChem (CID 57230247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).