1-butyl-4-(2-methoxyphenyl)piperazine

C15H24N2O — CID 10354670

IUPAC1-butyl-4-(2-methoxyphenyl)piperazine
SMILESCCCCN1CCN(c2ccccc2OC)CC1
InChIInChI=1S/C15H24N2O/c1-3-4-9-16-10-12-17(13-11-16)14-7-5-6-8-15(14)18-2/h5-8H,3-4,9-13H2,1-2H3
InChIKeyDCFYVNHQUVKFKK-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.62
Rot. Bonds5

About 1-butyl-4-(2-methoxyphenyl)piperazine

1-butyl-4-(2-methoxyphenyl)piperazine (PubChem CID 10354670) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-butyl-4-(2-methoxyphenyl)piperazine.

Molecular Properties

Compound Name1-butyl-4-(2-methoxyphenyl)piperazine
PubChem CID10354670
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-butyl-4-(2-methoxyphenyl)piperazine
SMILESCCCCN1CCN(c2ccccc2OC)CC1
InChIInChI=1S/C15H24N2O/c1-3-4-9-16-10-12-17(13-11-16)14-7-5-6-8-15(14)18-2/h5-8H,3-4,9-13H2,1-2H3
InChIKeyDCFYVNHQUVKFKK-UHFFFAOYSA-N
XLogP2.62
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-butyl-4-(2-methoxyphenyl)piperazine?
The IUPAC name of 1-butyl-4-(2-methoxyphenyl)piperazine (CID 10354670) is 1-butyl-4-(2-methoxyphenyl)piperazine.
What is the SMILES notation for 1-butyl-4-(2-methoxyphenyl)piperazine?
The canonical SMILES for 1-butyl-4-(2-methoxyphenyl)piperazine is CCCCN1CCN(c2ccccc2OC)CC1.
What is the InChIKey of 1-butyl-4-(2-methoxyphenyl)piperazine?
The InChIKey is DCFYVNHQUVKFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-4-9-16-10-12-17(13-11-16)14-7-5-6-8-15(14)18-2/h5-8H,3-4,9-13H2,1-2H3.
What are the key properties of 1-butyl-4-(2-methoxyphenyl)piperazine?
1-butyl-4-(2-methoxyphenyl)piperazine has a molecular weight of 248.37 g/mol, XLogP of 2.62, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-4-(2-methoxyphenyl)piperazine is sourced from PubChem (CID 10354670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).