1-(cyclobutylmethyl)piperazine

C9H18N2 — CID 952318

IUPAC1-(cyclobutylmethyl)piperazine
SMILESC1CC(CN2CCNCC2)C1
InChIInChI=1S/C9H18N2/c1-2-9(3-1)8-11-6-4-10-5-7-11/h9-10H,1-8H2
InChIKeyLYIJMNZARQYLPL-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.69
Rot. Bonds2

About 1-(cyclobutylmethyl)piperazine

1-(cyclobutylmethyl)piperazine (PubChem CID 952318) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)piperazine.

Molecular Properties

Compound Name1-(cyclobutylmethyl)piperazine
PubChem CID952318
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name1-(cyclobutylmethyl)piperazine
SMILESC1CC(CN2CCNCC2)C1
InChIInChI=1S/C9H18N2/c1-2-9(3-1)8-11-6-4-10-5-7-11/h9-10H,1-8H2
InChIKeyLYIJMNZARQYLPL-UHFFFAOYSA-N
XLogP0.69
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethyl)piperazine?
The IUPAC name of 1-(cyclobutylmethyl)piperazine (CID 952318) is 1-(cyclobutylmethyl)piperazine.
What is the SMILES notation for 1-(cyclobutylmethyl)piperazine?
The canonical SMILES for 1-(cyclobutylmethyl)piperazine is C1CC(CN2CCNCC2)C1.
What is the InChIKey of 1-(cyclobutylmethyl)piperazine?
The InChIKey is LYIJMNZARQYLPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-2-9(3-1)8-11-6-4-10-5-7-11/h9-10H,1-8H2.
What are the key properties of 1-(cyclobutylmethyl)piperazine?
1-(cyclobutylmethyl)piperazine has a molecular weight of 154.26 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)piperazine is sourced from PubChem (CID 952318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).