1-tert-butyl-4-cyclopentylpiperazine

C13H26N2 — CID 59737432

IUPAC1-tert-butyl-4-cyclopentylpiperazine
SMILESCC(C)(C)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C13H26N2/c1-13(2,3)15-10-8-14(9-11-15)12-6-4-5-7-12/h12H,4-11H2,1-3H3
InChIKeyGRTCUMAGTLYROQ-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.35
Rot. Bonds1

About 1-tert-butyl-4-cyclopentylpiperazine

1-tert-butyl-4-cyclopentylpiperazine (PubChem CID 59737432) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-tert-butyl-4-cyclopentylpiperazine.

Molecular Properties

Compound Name1-tert-butyl-4-cyclopentylpiperazine
PubChem CID59737432
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-tert-butyl-4-cyclopentylpiperazine
SMILESCC(C)(C)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C13H26N2/c1-13(2,3)15-10-8-14(9-11-15)12-6-4-5-7-12/h12H,4-11H2,1-3H3
InChIKeyGRTCUMAGTLYROQ-UHFFFAOYSA-N
XLogP2.35
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-4-cyclopentylpiperazine?
The IUPAC name of 1-tert-butyl-4-cyclopentylpiperazine (CID 59737432) is 1-tert-butyl-4-cyclopentylpiperazine.
What is the SMILES notation for 1-tert-butyl-4-cyclopentylpiperazine?
The canonical SMILES for 1-tert-butyl-4-cyclopentylpiperazine is CC(C)(C)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 1-tert-butyl-4-cyclopentylpiperazine?
The InChIKey is GRTCUMAGTLYROQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-13(2,3)15-10-8-14(9-11-15)12-6-4-5-7-12/h12H,4-11H2,1-3H3.
What are the key properties of 1-tert-butyl-4-cyclopentylpiperazine?
1-tert-butyl-4-cyclopentylpiperazine has a molecular weight of 210.36 g/mol, XLogP of 2.35, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-4-cyclopentylpiperazine is sourced from PubChem (CID 59737432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).