1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine

C16H34N2O2 — CID 103414058

IUPAC1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine
SMILESCCCC1CNC(C(C)C)CN1CCCOCCOC
InChIInChI=1S/C16H34N2O2/c1-5-7-15-12-17-16(14(2)3)13-18(15)8-6-9-20-11-10-19-4/h14-17H,5-13H2,1-4H3
InChIKeyGOAQYGVOOIKRBK-UHFFFAOYSA-N
MW286.46 g/mol
LogP2.14
Rot. Bonds10

About 1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine

1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine (PubChem CID 103414058) has the molecular formula C16H34N2O2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine.

Molecular Properties

Compound Name1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine
PubChem CID103414058
Molecular FormulaC16H34N2O2
Molecular Weight286.46 g/mol
Exact Mass286.26
IUPAC Name1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine
SMILESCCCC1CNC(C(C)C)CN1CCCOCCOC
InChIInChI=1S/C16H34N2O2/c1-5-7-15-12-17-16(14(2)3)13-18(15)8-6-9-20-11-10-19-4/h14-17H,5-13H2,1-4H3
InChIKeyGOAQYGVOOIKRBK-UHFFFAOYSA-N
XLogP2.14
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylpiperazine
CID 64840397
1-(2-butoxyethyl)-2-ethyl-5-propan-2-ylpiperazine
CID 64834120
1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-5-methyl-2-propylpiperazine
CID 104567840
2,5-di(propan-2-yl)-1-(3-propoxypropyl)piperazine
CID 82947777
1-(3-methoxy-3-methylbutyl)-5-propan-2-yl-2-propylpiperazine
CID 103016198
1-(2-butoxyethyl)-2-(2-methylpropyl)-5-propan-2-ylpiperazine
CID 64838649
1-(3,3-dimethylbutyl)-5-propan-2-yl-2-propylpiperazine
CID 64832139
2-ethyl-1-hexyl-5-propan-2-ylpiperazine
CID 64833921
(1-pentyl-5-propan-2-ylpiperazin-2-yl)methanol
CID 82242691
2-butan-2-yl-1-[3-(2-methoxyethoxy)propyl]-5-propylpiperazine
CID 103414108
5-butan-2-yl-2-cyclopropyl-1-[3-(2-methoxyethoxy)propyl]piperazine
CID 103414273
1-(1-methoxypropan-2-yl)-5-propan-2-yl-2-propylpiperazine
CID 113473149

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine?
The IUPAC name of 1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine (CID 103414058) is 1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine.
What is the SMILES notation for 1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine?
The canonical SMILES for 1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine is CCCC1CNC(C(C)C)CN1CCCOCCOC.
What is the InChIKey of 1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine?
The InChIKey is GOAQYGVOOIKRBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O2/c1-5-7-15-12-17-16(14(2)3)13-18(15)8-6-9-20-11-10-19-4/h14-17H,5-13H2,1-4H3.
What are the key properties of 1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine?
1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine has a molecular weight of 286.46 g/mol, XLogP of 2.14, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-methoxyethoxy)propyl]-5-propan-2-yl-2-propylpiperazine is sourced from PubChem (CID 103414058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).