1-pentyl-4-piperidin-4-ylpiperidine

C15H30N2 — CID 44592882

IUPAC1-pentyl-4-piperidin-4-ylpiperidine
SMILESCCCCCN1CCC(C2CCNCC2)CC1
InChIInChI=1S/C15H30N2/c1-2-3-4-11-17-12-7-15(8-13-17)14-5-9-16-10-6-14/h14-16H,2-13H2,1H3
InChIKeyLTGDHZCSONVEJW-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.89
Rot. Bonds5

About 1-pentyl-4-piperidin-4-ylpiperidine

1-pentyl-4-piperidin-4-ylpiperidine (PubChem CID 44592882) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-pentyl-4-piperidin-4-ylpiperidine.

Molecular Properties

Compound Name1-pentyl-4-piperidin-4-ylpiperidine
PubChem CID44592882
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-pentyl-4-piperidin-4-ylpiperidine
SMILESCCCCCN1CCC(C2CCNCC2)CC1
InChIInChI=1S/C15H30N2/c1-2-3-4-11-17-12-7-15(8-13-17)14-5-9-16-10-6-14/h14-16H,2-13H2,1H3
InChIKeyLTGDHZCSONVEJW-UHFFFAOYSA-N
XLogP2.89
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-pentyl-4-piperidin-4-ylpiperidine?
The IUPAC name of 1-pentyl-4-piperidin-4-ylpiperidine (CID 44592882) is 1-pentyl-4-piperidin-4-ylpiperidine.
What is the SMILES notation for 1-pentyl-4-piperidin-4-ylpiperidine?
The canonical SMILES for 1-pentyl-4-piperidin-4-ylpiperidine is CCCCCN1CCC(C2CCNCC2)CC1.
What is the InChIKey of 1-pentyl-4-piperidin-4-ylpiperidine?
The InChIKey is LTGDHZCSONVEJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-2-3-4-11-17-12-7-15(8-13-17)14-5-9-16-10-6-14/h14-16H,2-13H2,1H3.
What are the key properties of 1-pentyl-4-piperidin-4-ylpiperidine?
1-pentyl-4-piperidin-4-ylpiperidine has a molecular weight of 238.42 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pentyl-4-piperidin-4-ylpiperidine is sourced from PubChem (CID 44592882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).