2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine

C14H30N2O2 — CID 103414065

IUPAC2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine
SMILESCCC1(CC)CNCCN1CCCOCCOC
InChIInChI=1S/C14H30N2O2/c1-4-14(5-2)13-15-7-9-16(14)8-6-10-18-12-11-17-3/h15H,4-13H2,1-3H3
InChIKeyHLHUSBQOGFUUIF-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.50
Rot. Bonds9

About 2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine

2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine (PubChem CID 103414065) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine.

Molecular Properties

Compound Name2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine
PubChem CID103414065
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine
SMILESCCC1(CC)CNCCN1CCCOCCOC
InChIInChI=1S/C14H30N2O2/c1-4-14(5-2)13-15-7-9-16(14)8-6-10-18-12-11-17-3/h15H,4-13H2,1-3H3
InChIKeyHLHUSBQOGFUUIF-UHFFFAOYSA-N
XLogP1.50
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-cyclopropyl-1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-methylpiperazine
CID 104567834
2,2-diethyl-1-(2-phenoxyethyl)piperazine
CID 64846196
8-ethyl-6-[3-(2-methoxyethoxy)propyl]-8-methyl-6,9-diazaspiro[4.5]decane
CID 103414307
2,2-diethyl-1-methylpiperazine
CID 18770859
1-[3-(2-methoxyethoxy)propyl]-7-methyl-1,4-diazepane
CID 103414508
1-[3-(2-methoxyethoxy)propyl]-3,3-dimethylpiperazine
CID 103414045
1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine
CID 103410154
3-ethyl-1-[3-(2-methoxyethoxy)propyl]-3-methyl-1,4-diazepane
CID 103414496
1-[3-(2-methoxyethoxy)propyl]piperazin-2-one
CID 103412181
5-cyclopropyl-2,2-diethyl-1-(4-methoxybutyl)-5-methylpiperazine
CID 104650286
ethane;1-[2-(2-methoxyethoxy)ethyl]piperazine
CID 142390482
1-[3-(2-methoxyethoxy)propyl]-3-methylpiperazine
CID 103411083

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine?
The IUPAC name of 2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine (CID 103414065) is 2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine.
What is the SMILES notation for 2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine?
The canonical SMILES for 2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine is CCC1(CC)CNCCN1CCCOCCOC.
What is the InChIKey of 2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine?
The InChIKey is HLHUSBQOGFUUIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-4-14(5-2)13-15-7-9-16(14)8-6-10-18-12-11-17-3/h15H,4-13H2,1-3H3.
What are the key properties of 2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine?
2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine has a molecular weight of 258.41 g/mol, XLogP of 1.50, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine is sourced from PubChem (CID 103414065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).