5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine

C14H30N2O — CID 112592085

IUPAC5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine
SMILESCCC1(C)CN(CCOC(C)(C)C)C(C)CN1
InChIInChI=1S/C14H30N2O/c1-7-14(6)11-16(12(2)10-15-14)8-9-17-13(3,4)5/h12,15H,7-11H2,1-6H3
InChIKeyYXOXPIRFWZRXIX-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.26
Rot. Bonds4

About 5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine

5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine (PubChem CID 112592085) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine.

Molecular Properties

Compound Name5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine
PubChem CID112592085
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine
SMILESCCC1(C)CN(CCOC(C)(C)C)C(C)CN1
InChIInChI=1S/C14H30N2O/c1-7-14(6)11-16(12(2)10-15-14)8-9-17-13(3,4)5/h12,15H,7-11H2,1-6H3
InChIKeyYXOXPIRFWZRXIX-UHFFFAOYSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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
1-butyl-5-ethyl-2,5-dimethylpiperazine
CID 64849431
1-[2-(2,2-difluoroethoxy)ethyl]-5-ethyl-2,5-dimethylpiperazine
CID 114127962
1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine
CID 103465293
2-tert-butyl-1-(2-ethoxyethyl)-5-ethyl-5-methylpiperazine
CID 64848895
2-tert-butyl-5-ethyl-5-methyl-1-(2-propoxyethyl)piperazine
CID 106458706
3-ethyl-3,7-dimethyl-1-(2-propoxyethyl)-1,4-diazepane
CID 106458890
1-[2-(4-chlorophenyl)ethyl]-5-ethyl-2,5-dimethylpiperazine
CID 64934390
2-tert-butyl-5-ethyl-5-methyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64848897
1-(cyclohexylmethyl)-5-ethyl-2,5-dimethylpiperazine
CID 64847892
1-[2-(5-ethyl-2,5-dimethylpiperazin-1-yl)ethyl]pyridin-2-one
CID 82908046

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine?
The IUPAC name of 5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine (CID 112592085) is 5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine.
What is the SMILES notation for 5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine?
The canonical SMILES for 5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine is CCC1(C)CN(CCOC(C)(C)C)C(C)CN1.
What is the InChIKey of 5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine?
The InChIKey is YXOXPIRFWZRXIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-7-14(6)11-16(12(2)10-15-14)8-9-17-13(3,4)5/h12,15H,7-11H2,1-6H3.
What are the key properties of 5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine?
5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine has a molecular weight of 242.41 g/mol, XLogP of 2.26, 4 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-[(2-methylpropan-2-yl)oxy]ethyl]piperazine is sourced from PubChem (CID 112592085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).