5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine

C14H28N2O — CID 114106372

IUPAC5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine
SMILESCCC1(C)CN(CC2CCOC2C)C(C)CN1
InChIInChI=1S/C14H28N2O/c1-5-14(4)10-16(11(2)8-15-14)9-13-6-7-17-12(13)3/h11-13,15H,5-10H2,1-4H3
InChIKeyZYOSJSCVAXXKOS-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.87
Rot. Bonds3

About 5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine

5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine (PubChem CID 114106372) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine.

Molecular Properties

Compound Name5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine
PubChem CID114106372
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine
SMILESCCC1(C)CN(CC2CCOC2C)C(C)CN1
InChIInChI=1S/C14H28N2O/c1-5-14(4)10-16(11(2)8-15-14)9-13-6-7-17-12(13)3/h11-13,15H,5-10H2,1-4H3
InChIKeyZYOSJSCVAXXKOS-UHFFFAOYSA-N
XLogP1.87
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclohexylmethyl)-5-ethyl-2,5-dimethylpiperazine
CID 64847892
1-butyl-5-ethyl-2,5-dimethylpiperazine
CID 64849431
1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine
CID 103465293
5-ethyl-2,5-dimethyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine
CID 79350282
5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine
CID 112592085
5-ethyl-2,5-dimethyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64847117
5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine
CID 103016503
4-[(5-ethyl-2,5-dimethylpiperazin-1-yl)methyl]-3,5-dimethyl-1,2-oxazole
CID 79238559
1-[2-(4-chlorophenyl)ethyl]-5-ethyl-2,5-dimethylpiperazine
CID 64934390
1-[2-(2,2-difluoroethoxy)ethyl]-5-ethyl-2,5-dimethylpiperazine
CID 114127962
1-(cyclopropylmethyl)-2,5,5-trimethylpiperazine
CID 64840059
5-[2-(5-ethyl-2,5-dimethylpiperazin-1-yl)ethyl]-1,2,4-oxadiazole
CID 106408830

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine?
The IUPAC name of 5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine (CID 114106372) is 5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine.
What is the SMILES notation for 5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine?
The canonical SMILES for 5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine is CCC1(C)CN(CC2CCOC2C)C(C)CN1.
What is the InChIKey of 5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine?
The InChIKey is ZYOSJSCVAXXKOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-14(4)10-16(11(2)8-15-14)9-13-6-7-17-12(13)3/h11-13,15H,5-10H2,1-4H3.
What are the key properties of 5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine?
5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine has a molecular weight of 240.39 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine is sourced from PubChem (CID 114106372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).