2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine

C12H20N2S — CID 64846789

IUPAC2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine
SMILESCCC1(C)CNCCN1Cc1cccs1
InChIInChI=1S/C12H20N2S/c1-3-12(2)10-13-6-7-14(12)9-11-5-4-8-15-11/h4-5,8,13H,3,6-7,9-10H2,1-2H3
InChIKeyHGUUPJALEAPURN-UHFFFAOYSA-N
MW224.37 g/mol
LogP2.32
Rot. Bonds3

About 2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine

2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine (PubChem CID 64846789) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is 2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine.

Molecular Properties

Compound Name2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine
PubChem CID64846789
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC Name2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine
SMILESCCC1(C)CNCCN1Cc1cccs1
InChIInChI=1S/C12H20N2S/c1-3-12(2)10-13-6-7-14(12)9-11-5-4-8-15-11/h4-5,8,13H,3,6-7,9-10H2,1-2H3
InChIKeyHGUUPJALEAPURN-UHFFFAOYSA-N
XLogP2.32
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine?
The IUPAC name of 2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine (CID 64846789) is 2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine.
What is the SMILES notation for 2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine?
The canonical SMILES for 2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine is CCC1(C)CNCCN1Cc1cccs1.
What is the InChIKey of 2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine?
The InChIKey is HGUUPJALEAPURN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-3-12(2)10-13-6-7-14(12)9-11-5-4-8-15-11/h4-5,8,13H,3,6-7,9-10H2,1-2H3.
What are the key properties of 2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine?
2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine has a molecular weight of 224.37 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine is sourced from PubChem (CID 64846789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).