1-tert-butyl-4-piperidin-1-ylpiperidine

C14H28N2 — CID 20740797

IUPAC1-tert-butyl-4-piperidin-1-ylpiperidine
SMILESCC(C)(C)N1CCC(N2CCCCC2)CC1
InChIInChI=1S/C14H28N2/c1-14(2,3)16-11-7-13(8-12-16)15-9-5-4-6-10-15/h13H,4-12H2,1-3H3
InChIKeyLZZFFOIWHJFDSY-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.74
Rot. Bonds1

About 1-tert-butyl-4-piperidin-1-ylpiperidine

1-tert-butyl-4-piperidin-1-ylpiperidine (PubChem CID 20740797) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-tert-butyl-4-piperidin-1-ylpiperidine.

Molecular Properties

Compound Name1-tert-butyl-4-piperidin-1-ylpiperidine
PubChem CID20740797
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-tert-butyl-4-piperidin-1-ylpiperidine
SMILESCC(C)(C)N1CCC(N2CCCCC2)CC1
InChIInChI=1S/C14H28N2/c1-14(2,3)16-11-7-13(8-12-16)15-9-5-4-6-10-15/h13H,4-12H2,1-3H3
InChIKeyLZZFFOIWHJFDSY-UHFFFAOYSA-N
XLogP2.74
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.74
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-piperidin-1-ylpiperidine?
The IUPAC name of 1-tert-butyl-4-piperidin-1-ylpiperidine (CID 20740797) is 1-tert-butyl-4-piperidin-1-ylpiperidine.
What is the SMILES notation for 1-tert-butyl-4-piperidin-1-ylpiperidine?
The canonical SMILES for 1-tert-butyl-4-piperidin-1-ylpiperidine is CC(C)(C)N1CCC(N2CCCCC2)CC1.
What is the InChIKey of 1-tert-butyl-4-piperidin-1-ylpiperidine?
The InChIKey is LZZFFOIWHJFDSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-14(2,3)16-11-7-13(8-12-16)15-9-5-4-6-10-15/h13H,4-12H2,1-3H3.
What are the key properties of 1-tert-butyl-4-piperidin-1-ylpiperidine?
1-tert-butyl-4-piperidin-1-ylpiperidine has a molecular weight of 224.39 g/mol, XLogP of 2.74, 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-piperidin-1-ylpiperidine is sourced from PubChem (CID 20740797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).