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

C17H32N2O — CID 65170489

IUPAC5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine
SMILESCCC1(CC)CNC(C2CC2)CN1CCC1CCCO1
InChIInChI=1S/C17H32N2O/c1-3-17(4-2)13-18-16(14-7-8-14)12-19(17)10-9-15-6-5-11-20-15/h14-16,18H,3-13H2,1-2H3
InChIKeyZHGNMMNCMQTACQ-UHFFFAOYSA-N
MW280.46 g/mol
LogP2.80
Rot. Bonds6

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

5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine (PubChem CID 65170489) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine
PubChem CID65170489
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine
SMILESCCC1(CC)CNC(C2CC2)CN1CCC1CCCO1
InChIInChI=1S/C17H32N2O/c1-3-17(4-2)13-18-16(14-7-8-14)12-19(17)10-9-15-6-5-11-20-15/h14-16,18H,3-13H2,1-2H3
InChIKeyZHGNMMNCMQTACQ-UHFFFAOYSA-N
XLogP2.80
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine?
The IUPAC name of 5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine (CID 65170489) is 5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine.
What is the SMILES notation for 5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine?
The canonical SMILES for 5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine is CCC1(CC)CNC(C2CC2)CN1CCC1CCCO1.
What is the InChIKey of 5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine?
The InChIKey is ZHGNMMNCMQTACQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-3-17(4-2)13-18-16(14-7-8-14)12-19(17)10-9-15-6-5-11-20-15/h14-16,18H,3-13H2,1-2H3.
What are the key properties of 5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine?
5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine has a molecular weight of 280.46 g/mol, XLogP of 2.80, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine is sourced from PubChem (CID 65170489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).