2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine

C15H24N2S — CID 64843303

IUPAC2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine
SMILESCCC1CN(CCc2cccs2)C(C2CC2)CN1
InChIInChI=1S/C15H24N2S/c1-2-13-11-17(8-7-14-4-3-9-18-14)15(10-16-13)12-5-6-12/h3-4,9,12-13,15-16H,2,5-8,10-11H2,1H3
InChIKeyHGVRKBKBWTWNLH-UHFFFAOYSA-N
MW264.44 g/mol
LogP2.75
Rot. Bonds5

About 2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine

2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine (PubChem CID 64843303) has the molecular formula C15H24N2S and a molecular weight of 264.44 g/mol. Its IUPAC name is 2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine.

Molecular Properties

Compound Name2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine
PubChem CID64843303
Molecular FormulaC15H24N2S
Molecular Weight264.44 g/mol
Exact Mass264.17
IUPAC Name2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine
SMILESCCC1CN(CCc2cccs2)C(C2CC2)CN1
InChIInChI=1S/C15H24N2S/c1-2-13-11-17(8-7-14-4-3-9-18-14)15(10-16-13)12-5-6-12/h3-4,9,12-13,15-16H,2,5-8,10-11H2,1H3
InChIKeyHGVRKBKBWTWNLH-UHFFFAOYSA-N
XLogP2.75
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine?
The IUPAC name of 2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine (CID 64843303) is 2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine.
What is the SMILES notation for 2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine?
The canonical SMILES for 2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine is CCC1CN(CCc2cccs2)C(C2CC2)CN1.
What is the InChIKey of 2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine?
The InChIKey is HGVRKBKBWTWNLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2S/c1-2-13-11-17(8-7-14-4-3-9-18-14)15(10-16-13)12-5-6-12/h3-4,9,12-13,15-16H,2,5-8,10-11H2,1H3.
What are the key properties of 2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine?
2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine has a molecular weight of 264.44 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine is sourced from PubChem (CID 64843303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).