2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine

C16H32N2O2 — CID 64849325

IUPAC2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine
SMILESCOCCOCCN1CC(CC(C)C)NCC1C1CC1
InChIInChI=1S/C16H32N2O2/c1-13(2)10-15-12-18(6-7-20-9-8-19-3)16(11-17-15)14-4-5-14/h13-17H,4-12H2,1-3H3
InChIKeyPPYDPNPWNZELKC-UHFFFAOYSA-N
MW284.44 g/mol
LogP1.75
Rot. Bonds9

About 2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine

2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine (PubChem CID 64849325) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine
PubChem CID64849325
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine
SMILESCOCCOCCN1CC(CC(C)C)NCC1C1CC1
InChIInChI=1S/C16H32N2O2/c1-13(2)10-15-12-18(6-7-20-9-8-19-3)16(11-17-15)14-4-5-14/h13-17H,4-12H2,1-3H3
InChIKeyPPYDPNPWNZELKC-UHFFFAOYSA-N
XLogP1.75
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 51.75
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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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine?
The IUPAC name of 2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine (CID 64849325) is 2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine.
What is the SMILES notation for 2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine?
The canonical SMILES for 2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine is COCCOCCN1CC(CC(C)C)NCC1C1CC1.
What is the InChIKey of 2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine?
The InChIKey is PPYDPNPWNZELKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-13(2)10-15-12-18(6-7-20-9-8-19-3)16(11-17-15)14-4-5-14/h13-17H,4-12H2,1-3H3.
What are the key properties of 2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine?
2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine has a molecular weight of 284.44 g/mol, XLogP of 1.75, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-5-(2-methylpropyl)piperazine is sourced from PubChem (CID 64849325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).