1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine

C16H34N2O — CID 103016279

IUPAC1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine
SMILESCCCC1CN(CCC(C)(C)OC)C(CCC)CN1
InChIInChI=1S/C16H34N2O/c1-6-8-14-13-18(11-10-16(3,4)19-5)15(9-7-2)12-17-14/h14-15,17H,6-13H2,1-5H3
InChIKeyWMZHPAWJNYDEAZ-UHFFFAOYSA-N
MW270.46 g/mol
LogP3.04
Rot. Bonds8

About 1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine

1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine (PubChem CID 103016279) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine.

Molecular Properties

Compound Name1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine
PubChem CID103016279
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine
SMILESCCCC1CN(CCC(C)(C)OC)C(CCC)CN1
InChIInChI=1S/C16H34N2O/c1-6-8-14-13-18(11-10-16(3,4)19-5)15(9-7-2)12-17-14/h14-15,17H,6-13H2,1-5H3
InChIKeyWMZHPAWJNYDEAZ-UHFFFAOYSA-N
XLogP3.04
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methoxy-3-methylbutyl)-5-propan-2-yl-2-propylpiperazine
CID 103016198
1-(2-ethoxyethyl)-2,5-dipropylpiperazine
CID 64844595
1-(3-fluoropropyl)-2,5-dipropylpiperazine
CID 81114186
1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine
CID 64846765
5-ethyl-1-octyl-2-propylpiperazine
CID 64841338
1-(3,3-dimethylbutyl)-2-propan-2-yl-5-propylpiperazine
CID 64838194
1-(3,3-dimethylbutyl)-5-propan-2-yl-2-propylpiperazine
CID 64832139
1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine
CID 104766308
2-methyl-5-propyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64846379
2-ethyl-5-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]piperazine
CID 64845197
5-tert-butyl-1-heptyl-2-propylpiperazine
CID 64841631
2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine
CID 83146417

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine?
The IUPAC name of 1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine (CID 103016279) is 1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine.
What is the SMILES notation for 1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine?
The canonical SMILES for 1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine is CCCC1CN(CCC(C)(C)OC)C(CCC)CN1.
What is the InChIKey of 1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine?
The InChIKey is WMZHPAWJNYDEAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-6-8-14-13-18(11-10-16(3,4)19-5)15(9-7-2)12-17-14/h14-15,17H,6-13H2,1-5H3.
What are the key properties of 1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine?
1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine has a molecular weight of 270.46 g/mol, XLogP of 3.04, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine is sourced from PubChem (CID 103016279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).