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

C12H24N2O — CID 64924459

IUPAC3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine
SMILESCCC1CN(C(C)C2CCCO2)CCN1
InChIInChI=1S/C12H24N2O/c1-3-11-9-14(7-6-13-11)10(2)12-5-4-8-15-12/h10-13H,3-9H2,1-2H3
InChIKeyIUAUABYWHRKBCX-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.24
Rot. Bonds3

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

3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine (PubChem CID 64924459) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine.

Molecular Properties

Compound Name3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine
PubChem CID64924459
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine
SMILESCCC1CN(C(C)C2CCCO2)CCN1
InChIInChI=1S/C12H24N2O/c1-3-11-9-14(7-6-13-11)10(2)12-5-4-8-15-12/h10-13H,3-9H2,1-2H3
InChIKeyIUAUABYWHRKBCX-UHFFFAOYSA-N
XLogP1.24
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-ethyl-3-methyl-1-[1-(oxolan-2-yl)ethyl]-1,5-diazocane
CID 54973353
1-[1-(oxolan-2-yl)ethyl]piperazine
CID 60862286
1-[1-(oxolan-2-yl)ethyl]-3-propan-2-yl-1,4-diazepane
CID 64942765
3-ethyl-1-(2-methylpentan-3-yl)piperazine
CID 64925321
1-but-3-yn-2-yl-3-ethylpiperazine
CID 114420428
5-ethyl-1-[1-(oxan-4-yl)ethyl]-1,4-diazepane
CID 114115320
1-(1-cyclopentylethyl)-3-(2-methylpropyl)piperazine
CID 64953833
3-ethyl-1-(4-methoxybutan-2-yl)piperazine
CID 64953453
3,3-dimethyl-1-[1-(oxolan-2-yl)ethyl]-1,4-diazepane
CID 64945119
1-(1-cyclopropylethyl)-3-(2-methylpropyl)piperazine
CID 64926832
2-ethyl-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83244288
3-ethyl-1-pentan-3-yl-1,4-diazepane
CID 64943503

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine?
The IUPAC name of 3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine (CID 64924459) is 3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine.
What is the SMILES notation for 3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine?
The canonical SMILES for 3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine is CCC1CN(C(C)C2CCCO2)CCN1.
What is the InChIKey of 3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine?
The InChIKey is IUAUABYWHRKBCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-3-11-9-14(7-6-13-11)10(2)12-5-4-8-15-12/h10-13H,3-9H2,1-2H3.
What are the key properties of 3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine?
3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine has a molecular weight of 212.34 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-[1-(oxolan-2-yl)ethyl]piperazine is sourced from PubChem (CID 64924459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).