1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine

C11H24N2O2 — CID 103410154

IUPAC1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine
SMILESCOCCOCCCN1CCNCC1C
InChIInChI=1S/C11H24N2O2/c1-11-10-12-4-6-13(11)5-3-7-15-9-8-14-2/h11-12H,3-10H2,1-2H3
InChIKeyYHSAQJKMPNQUFI-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.33
Rot. Bonds7

About 1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine

1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine (PubChem CID 103410154) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine.

Molecular Properties

Compound Name1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine
PubChem CID103410154
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine
SMILESCOCCOCCCN1CCNCC1C
InChIInChI=1S/C11H24N2O2/c1-11-10-12-4-6-13(11)5-3-7-15-9-8-14-2/h11-12H,3-10H2,1-2H3
InChIKeyYHSAQJKMPNQUFI-UHFFFAOYSA-N
XLogP0.33
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.33
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 1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine?
The IUPAC name of 1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine (CID 103410154) is 1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine.
What is the SMILES notation for 1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine?
The canonical SMILES for 1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine is COCCOCCCN1CCNCC1C.
What is the InChIKey of 1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine?
The InChIKey is YHSAQJKMPNQUFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-11-10-12-4-6-13(11)5-3-7-15-9-8-14-2/h11-12H,3-10H2,1-2H3.
What are the key properties of 1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine?
1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine has a molecular weight of 216.32 g/mol, XLogP of 0.33, 7 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]-2-methylpiperazine is sourced from PubChem (CID 103410154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).