5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine

C15H28N2O — CID 114129860

IUPAC5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine
SMILESCCC1CNC(C2CC2)CN1CCC1CCOC1
InChIInChI=1S/C15H28N2O/c1-2-14-9-16-15(13-3-4-13)10-17(14)7-5-12-6-8-18-11-12/h12-16H,2-11H2,1H3
InChIKeyQPWIZUXTNVGUFC-UHFFFAOYSA-N
MW252.40 g/mol
LogP1.88
Rot. Bonds5

About 5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine

5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine (PubChem CID 114129860) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine
PubChem CID114129860
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine
SMILESCCC1CNC(C2CC2)CN1CCC1CCOC1
InChIInChI=1S/C15H28N2O/c1-2-14-9-16-15(13-3-4-13)10-17(14)7-5-12-6-8-18-11-12/h12-16H,2-11H2,1H3
InChIKeyQPWIZUXTNVGUFC-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine?
The IUPAC name of 5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine (CID 114129860) is 5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine.
What is the SMILES notation for 5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine?
The canonical SMILES for 5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine is CCC1CNC(C2CC2)CN1CCC1CCOC1.
What is the InChIKey of 5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine?
The InChIKey is QPWIZUXTNVGUFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-2-14-9-16-15(13-3-4-13)10-17(14)7-5-12-6-8-18-11-12/h12-16H,2-11H2,1H3.
What are the key properties of 5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine?
5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine has a molecular weight of 252.40 g/mol, XLogP of 1.88, 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-1-[2-(oxolan-3-yl)ethyl]piperazine is sourced from PubChem (CID 114129860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).