1-ethyl-2-(5-methylthiophen-2-yl)piperazine

C11H18N2S — CID 82673248

IUPAC1-ethyl-2-(5-methylthiophen-2-yl)piperazine
SMILESCCN1CCNCC1c1ccc(C)s1
InChIInChI=1S/C11H18N2S/c1-3-13-7-6-12-8-10(13)11-5-4-9(2)14-11/h4-5,10,12H,3,6-8H2,1-2H3
InChIKeyNFUYPHIFHFZGEQ-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.02
Rot. Bonds2

About 1-ethyl-2-(5-methylthiophen-2-yl)piperazine

1-ethyl-2-(5-methylthiophen-2-yl)piperazine (PubChem CID 82673248) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 1-ethyl-2-(5-methylthiophen-2-yl)piperazine.

Molecular Properties

Compound Name1-ethyl-2-(5-methylthiophen-2-yl)piperazine
PubChem CID82673248
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name1-ethyl-2-(5-methylthiophen-2-yl)piperazine
SMILESCCN1CCNCC1c1ccc(C)s1
InChIInChI=1S/C11H18N2S/c1-3-13-7-6-12-8-10(13)11-5-4-9(2)14-11/h4-5,10,12H,3,6-8H2,1-2H3
InChIKeyNFUYPHIFHFZGEQ-UHFFFAOYSA-N
XLogP2.02
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromophenyl)-1-ethylpiperazine
CID 82305436
2-(3,4-difluorophenyl)-1-ethylpiperazine
CID 67591073
4-(1-ethylpiperazin-2-yl)-N,N-dimethylaniline
CID 82290415
(1,1-dioxothian-4-yl)-[2-(5-methylthiophen-2-yl)piperazin-1-yl]methanone
CID 118016881
1-ethyl-2-(1H-imidazol-2-yl)piperazine
CID 82668736
3-(5-methylthiophen-2-yl)azetidine
CID 130160315
2-ethyl-1-[1-(5-methylthiophen-2-yl)ethyl]piperazine
CID 64930896
1-[(3-methylpyrrolidin-3-yl)methyl]-2-(5-methylthiophen-2-yl)pyrrolidine
CID 120900015
ethane;(2S)-1-ethyl-2-methylpiperazine
CID 154651366
1-[2-(4-ethylphenyl)piperazin-1-yl]-2-(5-methylthiophen-2-yl)ethanone
CID 120739990
1-ethyl-2-pyridin-2-yl-1,4-diazepane
CID 82283196
1-ethylpiperazin-2-amine;hydrazine
CID 121344900

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-(5-methylthiophen-2-yl)piperazine?
The IUPAC name of 1-ethyl-2-(5-methylthiophen-2-yl)piperazine (CID 82673248) is 1-ethyl-2-(5-methylthiophen-2-yl)piperazine.
What is the SMILES notation for 1-ethyl-2-(5-methylthiophen-2-yl)piperazine?
The canonical SMILES for 1-ethyl-2-(5-methylthiophen-2-yl)piperazine is CCN1CCNCC1c1ccc(C)s1.
What is the InChIKey of 1-ethyl-2-(5-methylthiophen-2-yl)piperazine?
The InChIKey is NFUYPHIFHFZGEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-3-13-7-6-12-8-10(13)11-5-4-9(2)14-11/h4-5,10,12H,3,6-8H2,1-2H3.
What are the key properties of 1-ethyl-2-(5-methylthiophen-2-yl)piperazine?
1-ethyl-2-(5-methylthiophen-2-yl)piperazine has a molecular weight of 210.35 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-(5-methylthiophen-2-yl)piperazine is sourced from PubChem (CID 82673248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).