4-tert-butyl-3-cyclopentylpiperidine

C14H27N — CID 112570800

IUPAC4-tert-butyl-3-cyclopentylpiperidine
SMILESCC(C)(C)C1CCNCC1C1CCCC1
InChIInChI=1S/C14H27N/c1-14(2,3)13-8-9-15-10-12(13)11-6-4-5-7-11/h11-13,15H,4-10H2,1-3H3
InChIKeyFDAZOUJKXLHBIW-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.45
Rot. Bonds1

About 4-tert-butyl-3-cyclopentylpiperidine

4-tert-butyl-3-cyclopentylpiperidine (PubChem CID 112570800) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 4-tert-butyl-3-cyclopentylpiperidine.

Molecular Properties

Compound Name4-tert-butyl-3-cyclopentylpiperidine
PubChem CID112570800
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name4-tert-butyl-3-cyclopentylpiperidine
SMILESCC(C)(C)C1CCNCC1C1CCCC1
InChIInChI=1S/C14H27N/c1-14(2,3)13-8-9-15-10-12(13)11-6-4-5-7-11/h11-13,15H,4-10H2,1-3H3
InChIKeyFDAZOUJKXLHBIW-UHFFFAOYSA-N
XLogP3.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-3-cyclopentylpiperidine?
The IUPAC name of 4-tert-butyl-3-cyclopentylpiperidine (CID 112570800) is 4-tert-butyl-3-cyclopentylpiperidine.
What is the SMILES notation for 4-tert-butyl-3-cyclopentylpiperidine?
The canonical SMILES for 4-tert-butyl-3-cyclopentylpiperidine is CC(C)(C)C1CCNCC1C1CCCC1.
What is the InChIKey of 4-tert-butyl-3-cyclopentylpiperidine?
The InChIKey is FDAZOUJKXLHBIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-14(2,3)13-8-9-15-10-12(13)11-6-4-5-7-11/h11-13,15H,4-10H2,1-3H3.
What are the key properties of 4-tert-butyl-3-cyclopentylpiperidine?
4-tert-butyl-3-cyclopentylpiperidine has a molecular weight of 209.38 g/mol, XLogP of 3.45, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-3-cyclopentylpiperidine is sourced from PubChem (CID 112570800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).