4-butyl-1-(2-piperidin-1-ylethyl)piperidine

C16H32N2 — CID 22970102

IUPAC4-butyl-1-(2-piperidin-1-ylethyl)piperidine
SMILESCCCCC1CCN(CCN2CCCCC2)CC1
InChIInChI=1S/C16H32N2/c1-2-3-7-16-8-12-18(13-9-16)15-14-17-10-5-4-6-11-17/h16H,2-15H2,1H3
InChIKeyZUAWNRIWUJBURF-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.37
Rot. Bonds6

About 4-butyl-1-(2-piperidin-1-ylethyl)piperidine

4-butyl-1-(2-piperidin-1-ylethyl)piperidine (PubChem CID 22970102) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 4-butyl-1-(2-piperidin-1-ylethyl)piperidine.

Molecular Properties

Compound Name4-butyl-1-(2-piperidin-1-ylethyl)piperidine
PubChem CID22970102
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name4-butyl-1-(2-piperidin-1-ylethyl)piperidine
SMILESCCCCC1CCN(CCN2CCCCC2)CC1
InChIInChI=1S/C16H32N2/c1-2-3-7-16-8-12-18(13-9-16)15-14-17-10-5-4-6-11-17/h16H,2-15H2,1H3
InChIKeyZUAWNRIWUJBURF-UHFFFAOYSA-N
XLogP3.37
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-butyl-1-(2-piperidin-1-ylethyl)piperidine?
The IUPAC name of 4-butyl-1-(2-piperidin-1-ylethyl)piperidine (CID 22970102) is 4-butyl-1-(2-piperidin-1-ylethyl)piperidine.
What is the SMILES notation for 4-butyl-1-(2-piperidin-1-ylethyl)piperidine?
The canonical SMILES for 4-butyl-1-(2-piperidin-1-ylethyl)piperidine is CCCCC1CCN(CCN2CCCCC2)CC1.
What is the InChIKey of 4-butyl-1-(2-piperidin-1-ylethyl)piperidine?
The InChIKey is ZUAWNRIWUJBURF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-2-3-7-16-8-12-18(13-9-16)15-14-17-10-5-4-6-11-17/h16H,2-15H2,1H3.
What are the key properties of 4-butyl-1-(2-piperidin-1-ylethyl)piperidine?
4-butyl-1-(2-piperidin-1-ylethyl)piperidine has a molecular weight of 252.45 g/mol, XLogP of 3.37, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-1-(2-piperidin-1-ylethyl)piperidine is sourced from PubChem (CID 22970102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).