5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine

C16H26N2S — CID 64861458

IUPAC5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine
SMILESCC(C)C1CNC(C2CC2)CN1CCc1ccsc1
InChIInChI=1S/C16H26N2S/c1-12(2)16-9-17-15(14-3-4-14)10-18(16)7-5-13-6-8-19-11-13/h6,8,11-12,14-17H,3-5,7,9-10H2,1-2H3
InChIKeyWQGCALQCINPFSZ-UHFFFAOYSA-N
MW278.46 g/mol
LogP3.00
Rot. Bonds5

About 5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine

5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine (PubChem CID 64861458) has the molecular formula C16H26N2S and a molecular weight of 278.46 g/mol. Its IUPAC name is 5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine
PubChem CID64861458
Molecular FormulaC16H26N2S
Molecular Weight278.46 g/mol
Exact Mass278.18
IUPAC Name5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine
SMILESCC(C)C1CNC(C2CC2)CN1CCc1ccsc1
InChIInChI=1S/C16H26N2S/c1-12(2)16-9-17-15(14-3-4-14)10-18(16)7-5-13-6-8-19-11-13/h6,8,11-12,14-17H,3-5,7,9-10H2,1-2H3
InChIKeyWQGCALQCINPFSZ-UHFFFAOYSA-N
XLogP3.00
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.46
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopropyl-2-propan-2-yl-1-(2-pyridin-3-ylethyl)piperazine
CID 64933236
1-[2-(cyclohexen-1-yl)ethyl]-5-cyclopropyl-2-propan-2-ylpiperazine
CID 107854279
5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine
CID 64941954
1-[(4-bromothiophen-2-yl)methyl]-5-cyclopropyl-2-propan-2-ylpiperazine
CID 64861648
5-cyclohexyl-2-propan-2-yl-1-propylpiperazine
CID 64861326
5-cyclopropyl-1-(3-ethylsulfonylpropyl)-2-propan-2-ylpiperazine
CID 65097323
2-ethyl-5-(2-methylpropyl)-1-(2-thiophen-3-ylethyl)piperazine
CID 64849303
3-butan-2-yl-7-methyl-1-(2-thiophen-3-ylethyl)-1,4-diazepane
CID 64869370
2-propan-2-yl-1-(thiophen-3-ylmethyl)piperazine
CID 64833156
5-cyclopropyl-1-[(2-methoxyphenyl)methyl]-2-propan-2-ylpiperazine
CID 64861840
1-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-5-cyclopropyl-2-propan-2-ylpiperazine
CID 66395287
5-cyclopropyl-1-[(2,5-difluorophenyl)methyl]-2-propan-2-ylpiperazine
CID 64861649

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine?
The IUPAC name of 5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine (CID 64861458) is 5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine.
What is the SMILES notation for 5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine?
The canonical SMILES for 5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine is CC(C)C1CNC(C2CC2)CN1CCc1ccsc1.
What is the InChIKey of 5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine?
The InChIKey is WQGCALQCINPFSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2S/c1-12(2)16-9-17-15(14-3-4-14)10-18(16)7-5-13-6-8-19-11-13/h6,8,11-12,14-17H,3-5,7,9-10H2,1-2H3.
What are the key properties of 5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine?
5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine has a molecular weight of 278.46 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-propan-2-yl-1-(2-thiophen-3-ylethyl)piperazine is sourced from PubChem (CID 64861458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).