1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine

C14H28N2O — CID 156719972

IUPAC1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine
SMILESCC(C)OC1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C14H28N2O/c1-12(2)17-14-5-9-16(10-6-14)11-13-3-7-15-8-4-13/h12-15H,3-11H2,1-2H3
InChIKeyHJQSKQAADAZEIP-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.88
Rot. Bonds4

About 1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine

1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine (PubChem CID 156719972) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine.

Molecular Properties

Compound Name1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine
PubChem CID156719972
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine
SMILESCC(C)OC1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C14H28N2O/c1-12(2)17-14-5-9-16(10-6-14)11-13-3-7-15-8-4-13/h12-15H,3-11H2,1-2H3
InChIKeyHJQSKQAADAZEIP-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine?
The IUPAC name of 1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine (CID 156719972) is 1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine.
What is the SMILES notation for 1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine?
The canonical SMILES for 1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine is CC(C)OC1CCN(CC2CCNCC2)CC1.
What is the InChIKey of 1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine?
The InChIKey is HJQSKQAADAZEIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12(2)17-14-5-9-16(10-6-14)11-13-3-7-15-8-4-13/h12-15H,3-11H2,1-2H3.
What are the key properties of 1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine?
1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine has a molecular weight of 240.39 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(piperidin-4-ylmethyl)-4-propan-2-yloxypiperidine is sourced from PubChem (CID 156719972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).