2-tert-butyl-1-cyclopentylpiperidine

C14H27N — CID 58564040

IUPAC2-tert-butyl-1-cyclopentylpiperidine
SMILESCC(C)(C)C1CCCCN1C1CCCC1
InChIInChI=1S/C14H27N/c1-14(2,3)13-10-6-7-11-15(13)12-8-4-5-9-12/h12-13H,4-11H2,1-3H3
InChIKeyVFPSIJAIXRYOJG-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.83
Rot. Bonds1

About 2-tert-butyl-1-cyclopentylpiperidine

2-tert-butyl-1-cyclopentylpiperidine (PubChem CID 58564040) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 2-tert-butyl-1-cyclopentylpiperidine.

Molecular Properties

Compound Name2-tert-butyl-1-cyclopentylpiperidine
PubChem CID58564040
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name2-tert-butyl-1-cyclopentylpiperidine
SMILESCC(C)(C)C1CCCCN1C1CCCC1
InChIInChI=1S/C14H27N/c1-14(2,3)13-10-6-7-11-15(13)12-8-4-5-9-12/h12-13H,4-11H2,1-3H3
InChIKeyVFPSIJAIXRYOJG-UHFFFAOYSA-N
XLogP3.83
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-1-cyclopentylpiperidine?
The IUPAC name of 2-tert-butyl-1-cyclopentylpiperidine (CID 58564040) is 2-tert-butyl-1-cyclopentylpiperidine.
What is the SMILES notation for 2-tert-butyl-1-cyclopentylpiperidine?
The canonical SMILES for 2-tert-butyl-1-cyclopentylpiperidine is CC(C)(C)C1CCCCN1C1CCCC1.
What is the InChIKey of 2-tert-butyl-1-cyclopentylpiperidine?
The InChIKey is VFPSIJAIXRYOJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-14(2,3)13-10-6-7-11-15(13)12-8-4-5-9-12/h12-13H,4-11H2,1-3H3.
What are the key properties of 2-tert-butyl-1-cyclopentylpiperidine?
2-tert-butyl-1-cyclopentylpiperidine has a molecular weight of 209.38 g/mol, XLogP of 3.83, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-1-cyclopentylpiperidine is sourced from PubChem (CID 58564040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).