5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine

C16H26N2S — CID 64875957

IUPAC5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine
SMILESCCC1CNC(C)(C2CC2)CN1CCc1ccsc1
InChIInChI=1S/C16H26N2S/c1-3-15-10-17-16(2,14-4-5-14)12-18(15)8-6-13-7-9-19-11-13/h7,9,11,14-15,17H,3-6,8,10,12H2,1-2H3
InChIKeyPKUWWFDKHOLHJQ-UHFFFAOYSA-N
MW278.46 g/mol
LogP3.14
Rot. Bonds5

About 5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine

5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine (PubChem CID 64875957) has the molecular formula C16H26N2S and a molecular weight of 278.46 g/mol. Its IUPAC name is 5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine
PubChem CID64875957
Molecular FormulaC16H26N2S
Molecular Weight278.46 g/mol
Exact Mass278.18
IUPAC Name5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine
SMILESCCC1CNC(C)(C2CC2)CN1CCc1ccsc1
InChIInChI=1S/C16H26N2S/c1-3-15-10-17-16(2,14-4-5-14)12-18(15)8-6-13-7-9-19-11-13/h7,9,11,14-15,17H,3-6,8,10,12H2,1-2H3
InChIKeyPKUWWFDKHOLHJQ-UHFFFAOYSA-N
XLogP3.14
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 ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopropyl-2-ethyl-1-hexyl-5-methylpiperazine
CID 64876529
8-(2-methylpropyl)-9-(2-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane
CID 64876228
2-[(5-cyclopropyl-2-ethyl-5-methylpiperazin-1-yl)methyl]-1,3-thiazole
CID 64948017
2-ethyl-5-(2-methylpropyl)-1-(2-thiophen-3-ylethyl)piperazine
CID 64849303
3-(5-cyclopropyl-2-ethyl-5-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine
CID 64935005
2-tert-butyl-5,5-diethyl-1-(2-thiophen-3-ylethyl)piperazine
CID 64860254
2-butan-2-yl-5-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine
CID 64847544
5-cyclopropyl-2-ethyl-5-methyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64875953
8-butan-2-yl-9-(2-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane
CID 64877949
1-[(5-bromo-2-pyridinyl)methyl]-5-cyclopropyl-2-ethyl-5-methylpiperazine
CID 104812551
5-cyclopropyl-2-ethyl-5-methyl-1-[2-(3-methylbutoxy)ethyl]piperazine
CID 64875764
1-[(5-bromo-2-fluorophenyl)methyl]-5-cyclopropyl-2-ethyl-5-methylpiperazine
CID 64875773

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine?
The IUPAC name of 5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine (CID 64875957) is 5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine.
What is the SMILES notation for 5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine?
The canonical SMILES for 5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine is CCC1CNC(C)(C2CC2)CN1CCc1ccsc1.
What is the InChIKey of 5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine?
The InChIKey is PKUWWFDKHOLHJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2S/c1-3-15-10-17-16(2,14-4-5-14)12-18(15)8-6-13-7-9-19-11-13/h7,9,11,14-15,17H,3-6,8,10,12H2,1-2H3.
What are the key properties of 5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine?
5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine has a molecular weight of 278.46 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-ethyl-5-methyl-1-(2-thiophen-3-ylethyl)piperazine is sourced from PubChem (CID 64875957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).