2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine

C11H22N2O — CID 64845102

IUPAC2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine
SMILESCOCCN1CC(C)NCC1C1CC1
InChIInChI=1S/C11H22N2O/c1-9-8-13(5-6-14-2)11(7-12-9)10-3-4-10/h9-12H,3-8H2,1-2H3
InChIKeyTUMYMSGEXOOWBF-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.71
Rot. Bonds4

About 2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine

2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine (PubChem CID 64845102) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine.

Molecular Properties

Compound Name2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine
PubChem CID64845102
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine
SMILESCOCCN1CC(C)NCC1C1CC1
InChIInChI=1S/C11H22N2O/c1-9-8-13(5-6-14-2)11(7-12-9)10-3-4-10/h9-12H,3-8H2,1-2H3
InChIKeyTUMYMSGEXOOWBF-UHFFFAOYSA-N
XLogP0.71
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine?
The IUPAC name of 2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine (CID 64845102) is 2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine.
What is the SMILES notation for 2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine?
The canonical SMILES for 2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine is COCCN1CC(C)NCC1C1CC1.
What is the InChIKey of 2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine?
The InChIKey is TUMYMSGEXOOWBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9-8-13(5-6-14-2)11(7-12-9)10-3-4-10/h9-12H,3-8H2,1-2H3.
What are the key properties of 2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine?
2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine has a molecular weight of 198.31 g/mol, XLogP of 0.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine is sourced from PubChem (CID 64845102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).