5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine

C14H28N2O — CID 64946387

IUPAC5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine
SMILESCCC1CNC(C2CC2)CN1CC(C)COC
InChIInChI=1S/C14H28N2O/c1-4-13-7-15-14(12-5-6-12)9-16(13)8-11(2)10-17-3/h11-15H,4-10H2,1-3H3
InChIKeyYLPXTJMCCSJGSB-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.73
Rot. Bonds6

About 5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine

5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine (PubChem CID 64946387) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine
PubChem CID64946387
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine
SMILESCCC1CNC(C2CC2)CN1CC(C)COC
InChIInChI=1S/C14H28N2O/c1-4-13-7-15-14(12-5-6-12)9-16(13)8-11(2)10-17-3/h11-15H,4-10H2,1-3H3
InChIKeyYLPXTJMCCSJGSB-UHFFFAOYSA-N
XLogP1.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine?
The IUPAC name of 5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine (CID 64946387) is 5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine.
What is the SMILES notation for 5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine?
The canonical SMILES for 5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine is CCC1CNC(C2CC2)CN1CC(C)COC.
What is the InChIKey of 5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine?
The InChIKey is YLPXTJMCCSJGSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-13-7-15-14(12-5-6-12)9-16(13)8-11(2)10-17-3/h11-15H,4-10H2,1-3H3.
What are the key properties of 5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine?
5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine has a molecular weight of 240.39 g/mol, XLogP of 1.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-ethyl-1-(3-methoxy-2-methylpropyl)piperazine is sourced from PubChem (CID 64946387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).