5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine

C14H26N2O — CID 64861065

IUPAC5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine
SMILESCCC1CNC(C2CC2)CN1CC1CCOC1
InChIInChI=1S/C14H26N2O/c1-2-13-7-15-14(12-3-4-12)9-16(13)8-11-5-6-17-10-11/h11-15H,2-10H2,1H3
InChIKeyALWZTKYRLZUANC-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.49
Rot. Bonds4

About 5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine

5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine (PubChem CID 64861065) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine
PubChem CID64861065
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine
SMILESCCC1CNC(C2CC2)CN1CC1CCOC1
InChIInChI=1S/C14H26N2O/c1-2-13-7-15-14(12-3-4-12)9-16(13)8-11-5-6-17-10-11/h11-15H,2-10H2,1H3
InChIKeyALWZTKYRLZUANC-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.49
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-(oxolan-3-ylmethyl)piperazine?
The IUPAC name of 5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine (CID 64861065) is 5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine.
What is the SMILES notation for 5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine?
The canonical SMILES for 5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine is CCC1CNC(C2CC2)CN1CC1CCOC1.
What is the InChIKey of 5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine?
The InChIKey is ALWZTKYRLZUANC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-2-13-7-15-14(12-3-4-12)9-16(13)8-11-5-6-17-10-11/h11-15H,2-10H2,1H3.
What are the key properties of 5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine?
5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine has a molecular weight of 238.37 g/mol, XLogP of 1.49, 4 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-(oxolan-3-ylmethyl)piperazine is sourced from PubChem (CID 64861065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).