5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine

C14H30N2O — CID 103016503

IUPAC5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine
SMILESCCC1(C)CN(CCC(C)(C)OC)C(C)CN1
InChIInChI=1S/C14H30N2O/c1-7-14(5)11-16(12(2)10-15-14)9-8-13(3,4)17-6/h12,15H,7-11H2,1-6H3
InChIKeyOASNICPYJPKDAN-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.26
Rot. Bonds5

About 5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine

5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine (PubChem CID 103016503) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine.

Molecular Properties

Compound Name5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine
PubChem CID103016503
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine
SMILESCCC1(C)CN(CCC(C)(C)OC)C(C)CN1
InChIInChI=1S/C14H30N2O/c1-7-14(5)11-16(12(2)10-15-14)9-8-13(3,4)17-6/h12,15H,7-11H2,1-6H3
InChIKeyOASNICPYJPKDAN-UHFFFAOYSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
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-[(2-methylpropan-2-yl)oxy]ethyl]piperazine
CID 112592085
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-propan-2-yloxyethyl)piperazine
CID 64847117
1-[2-(2,2-difluoroethoxy)ethyl]-5-ethyl-2,5-dimethylpiperazine
CID 114127962
2-butan-2-yl-5,5-diethyl-1-(3-methoxy-3-methylbutyl)piperazine
CID 103016623
1-[2-(4-chlorophenyl)ethyl]-5-ethyl-2,5-dimethylpiperazine
CID 64934390
1-(cyclohexylmethyl)-5-ethyl-2,5-dimethylpiperazine
CID 64847892
5-cyclopropyl-1-(3-methoxy-3-methylbutyl)-5-methyl-2-propan-2-ylpiperazine
CID 103016594
5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine
CID 64947335
5,5-diethyl-2-methyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64860416
8-tert-butyl-9-(3-methoxy-3-methylbutyl)-6,9-diazaspiro[4.5]decane
CID 103016557

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine?
The IUPAC name of 5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine (CID 103016503) is 5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine.
What is the SMILES notation for 5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine?
The canonical SMILES for 5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine is CCC1(C)CN(CCC(C)(C)OC)C(C)CN1.
What is the InChIKey of 5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine?
The InChIKey is OASNICPYJPKDAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-7-14(5)11-16(12(2)10-15-14)9-8-13(3,4)17-6/h12,15H,7-11H2,1-6H3.
What are the key properties of 5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine?
5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine has a molecular weight of 242.41 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine is sourced from PubChem (CID 103016503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).