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

C16H24N2S — CID 64859740

IUPAC2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine
SMILESc1csc(CCN2CC(C3CC3)NCC2C2CC2)c1
InChIInChI=1S/C16H24N2S/c1-2-14(19-9-1)7-8-18-11-15(12-3-4-12)17-10-16(18)13-5-6-13/h1-2,9,12-13,15-17H,3-8,10-11H2
InChIKeySWBDNHTWSSRAKT-UHFFFAOYSA-N
MW276.45 g/mol
LogP2.75
Rot. Bonds5

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

2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine (PubChem CID 64859740) has the molecular formula C16H24N2S and a molecular weight of 276.45 g/mol. Its IUPAC name is 2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine.

Molecular Properties

Compound Name2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine
PubChem CID64859740
Molecular FormulaC16H24N2S
Molecular Weight276.45 g/mol
Exact Mass276.17
IUPAC Name2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine
SMILESc1csc(CCN2CC(C3CC3)NCC2C2CC2)c1
InChIInChI=1S/C16H24N2S/c1-2-14(19-9-1)7-8-18-11-15(12-3-4-12)17-10-16(18)13-5-6-13/h1-2,9,12-13,15-17H,3-8,10-11H2
InChIKeySWBDNHTWSSRAKT-UHFFFAOYSA-N
XLogP2.75
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.45
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64843303
5-butan-2-yl-2-cyclopropyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64848434
2-cyclopropyl-5-ethyl-5-methyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64847174
2-butan-2-yl-5-cyclopropyl-1-(thiophen-2-ylmethyl)piperazine
CID 64862427
3-cyclohexyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64833084
2-pyrrolidin-2-yl-1-(2-thiophen-2-ylethyl)piperidine
CID 63775718
5-cyclopropyl-2-methyl-1-(2-methyl-2-thiophen-2-ylpropyl)piperazine
CID 80527617
2-tert-butyl-5-methyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64844009
1-[(2-chlorophenyl)methyl]-2,5-dicyclopropylpiperazine
CID 64860320
1-[(3-chlorophenyl)methyl]-2,5-dicyclopropylpiperazine
CID 64862434
2-[2-(5-cyclopropyl-2-methylpiperazin-1-yl)ethyl]-1,3-thiazole
CID 64942156
2,5-dicyclopropyl-1-(pyridin-3-ylmethyl)piperazine
CID 64861091

Frequently Asked Questions

What is the IUPAC name of 2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine?
The IUPAC name of 2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine (CID 64859740) is 2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine.
What is the SMILES notation for 2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine?
The canonical SMILES for 2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine is c1csc(CCN2CC(C3CC3)NCC2C2CC2)c1.
What is the InChIKey of 2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine?
The InChIKey is SWBDNHTWSSRAKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2S/c1-2-14(19-9-1)7-8-18-11-15(12-3-4-12)17-10-16(18)13-5-6-13/h1-2,9,12-13,15-17H,3-8,10-11H2.
What are the key properties of 2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine?
2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine has a molecular weight of 276.45 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 2,5-dicyclopropyl-1-(2-thiophen-2-ylethyl)piperazine is sourced from PubChem (CID 64859740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).