1-(piperidin-4-ylmethyl)piperidin-4-ol

C11H22N2O — CID 22047942

IUPAC1-(piperidin-4-ylmethyl)piperidin-4-ol
SMILESOC1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C11H22N2O/c14-11-3-7-13(8-4-11)9-10-1-5-12-6-2-10/h10-12,14H,1-9H2
InChIKeyDJSIQNWLZJXUHG-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.44
Rot. Bonds2

About 1-(piperidin-4-ylmethyl)piperidin-4-ol

1-(piperidin-4-ylmethyl)piperidin-4-ol (PubChem CID 22047942) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-(piperidin-4-ylmethyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(piperidin-4-ylmethyl)piperidin-4-ol
PubChem CID22047942
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-(piperidin-4-ylmethyl)piperidin-4-ol
SMILESOC1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C11H22N2O/c14-11-3-7-13(8-4-11)9-10-1-5-12-6-2-10/h10-12,14H,1-9H2
InChIKeyDJSIQNWLZJXUHG-UHFFFAOYSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(piperidin-4-ylmethyl)piperidin-4-ol?
The IUPAC name of 1-(piperidin-4-ylmethyl)piperidin-4-ol (CID 22047942) is 1-(piperidin-4-ylmethyl)piperidin-4-ol.
What is the SMILES notation for 1-(piperidin-4-ylmethyl)piperidin-4-ol?
The canonical SMILES for 1-(piperidin-4-ylmethyl)piperidin-4-ol is OC1CCN(CC2CCNCC2)CC1.
What is the InChIKey of 1-(piperidin-4-ylmethyl)piperidin-4-ol?
The InChIKey is DJSIQNWLZJXUHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c14-11-3-7-13(8-4-11)9-10-1-5-12-6-2-10/h10-12,14H,1-9H2.
What are the key properties of 1-(piperidin-4-ylmethyl)piperidin-4-ol?
1-(piperidin-4-ylmethyl)piperidin-4-ol has a molecular weight of 198.31 g/mol, XLogP of 0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(piperidin-4-ylmethyl)piperidin-4-ol is sourced from PubChem (CID 22047942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).