2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine

C16H28N2S — CID 64841398

IUPAC2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine
SMILESCCC1CN(CCc2cccs2)C(CC)(CC)CN1
InChIInChI=1S/C16H28N2S/c1-4-14-12-18(10-9-15-8-7-11-19-15)16(5-2,6-3)13-17-14/h7-8,11,14,17H,4-6,9-10,12-13H2,1-3H3
InChIKeyOQZBYDUGALFOEN-UHFFFAOYSA-N
MW280.48 g/mol
LogP3.53
Rot. Bonds6

About 2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine

2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine (PubChem CID 64841398) has the molecular formula C16H28N2S and a molecular weight of 280.48 g/mol. Its IUPAC name is 2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine.

Molecular Properties

Compound Name2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine
PubChem CID64841398
Molecular FormulaC16H28N2S
Molecular Weight280.48 g/mol
Exact Mass280.20
IUPAC Name2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine
SMILESCCC1CN(CCc2cccs2)C(CC)(CC)CN1
InChIInChI=1S/C16H28N2S/c1-4-14-12-18(10-9-15-8-7-11-19-15)16(5-2,6-3)13-17-14/h7-8,11,14,17H,4-6,9-10,12-13H2,1-3H3
InChIKeyOQZBYDUGALFOEN-UHFFFAOYSA-N
XLogP3.53
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.48
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-diethyl-5-methyl-1-(thiophen-2-ylmethyl)piperazine
CID 64845724
2,2,5-trimethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64845507
2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64843303
5-cyclopropyl-2-ethyl-2,5-dimethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64878294
2,2-dimethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 63774564
2,5,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64862344
5-benzyl-2,2-diethyl-1-(2-methoxyethyl)piperazine
CID 64847634
1-[(5-bromo-2-pyridinyl)methyl]-2,2,5-triethylpiperazine
CID 104812451
1-[(3,4-dimethylphenyl)methyl]-2,2,5-triethylpiperazine
CID 64843731
2,2,5-triethyl-1-[(4-methoxyphenyl)methyl]piperazine
CID 64842179
3-propyl-1-(2-thiophen-2-ylethyl)-2,3,4,5-tetrahydro-1,4-benzodiazepine
CID 79907403
2,2,5-triethyl-1-prop-2-enylpiperazine
CID 64842758

Frequently Asked Questions

What is the IUPAC name of 2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine?
The IUPAC name of 2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine (CID 64841398) is 2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine.
What is the SMILES notation for 2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine?
The canonical SMILES for 2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine is CCC1CN(CCc2cccs2)C(CC)(CC)CN1.
What is the InChIKey of 2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine?
The InChIKey is OQZBYDUGALFOEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2S/c1-4-14-12-18(10-9-15-8-7-11-19-15)16(5-2,6-3)13-17-14/h7-8,11,14,17H,4-6,9-10,12-13H2,1-3H3.
What are the key properties of 2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine?
2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine has a molecular weight of 280.48 g/mol, XLogP of 3.53, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5-triethyl-1-(2-thiophen-2-ylethyl)piperazine is sourced from PubChem (CID 64841398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).