2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine

C14H24N2S — CID 64846847

IUPAC2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine
SMILESCC(C)CC1CNCCN1CCc1cccs1
InChIInChI=1S/C14H24N2S/c1-12(2)10-13-11-15-6-8-16(13)7-5-14-4-3-9-17-14/h3-4,9,12-13,15H,5-8,10-11H2,1-2H3
InChIKeyISORCKFGHMHOEP-UHFFFAOYSA-N
MW252.43 g/mol
LogP2.61
Rot. Bonds5

About 2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine

2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine (PubChem CID 64846847) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine.

Molecular Properties

Compound Name2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine
PubChem CID64846847
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine
SMILESCC(C)CC1CNCCN1CCc1cccs1
InChIInChI=1S/C14H24N2S/c1-12(2)10-13-11-15-6-8-16(13)7-5-14-4-3-9-17-14/h3-4,9,12-13,15H,5-8,10-11H2,1-2H3
InChIKeyISORCKFGHMHOEP-UHFFFAOYSA-N
XLogP2.61
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(4-methoxyphenyl)ethyl]-2-(2-methylpropyl)piperazine
CID 65441884
1-(2-fluoroethyl)-2-(2-methylpropyl)piperazine
CID 80694838
2-butan-2-yl-5-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine
CID 64849704
2-methyl-1-(1-thiophen-2-ylpropan-2-yl)piperazine
CID 64930534
2-(2-methylpropyl)-1-(3-methylsulfonylpropyl)piperazine
CID 64844470
1-[3-(4-methylphenoxy)propyl]-2-(2-methylpropyl)piperazine
CID 82250822
2-methyl-1-[2-(2-methylpropyl)piperazin-1-yl]propan-2-amine
CID 112546747
1-(2,3-dihydro-1-benzothiophen-2-ylmethyl)-2-(2-methylpropyl)piperazine
CID 79224036
1-[(4-tert-butylphenyl)methyl]-2-(2-methylpropyl)piperazine
CID 64844274
2-(chloromethyl)-1-(2-thiophen-2-ylethyl)piperidine
CID 63775037
2,2-dimethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 63774564
[4-methoxy-1-(2-thiophen-2-ylethyl)piperidin-2-yl]methanamine
CID 112622527

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine?
The IUPAC name of 2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine (CID 64846847) is 2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine.
What is the SMILES notation for 2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine?
The canonical SMILES for 2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine is CC(C)CC1CNCCN1CCc1cccs1.
What is the InChIKey of 2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine?
The InChIKey is ISORCKFGHMHOEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-12(2)10-13-11-15-6-8-16(13)7-5-14-4-3-9-17-14/h3-4,9,12-13,15H,5-8,10-11H2,1-2H3.
What are the key properties of 2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine?
2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine has a molecular weight of 252.43 g/mol, XLogP of 2.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine is sourced from PubChem (CID 64846847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).