4-benzyl-1,2,5-trimethylpiperidin-4-ol

C15H23NO — CID 612649

IUPAC4-benzyl-1,2,5-trimethylpiperidin-4-ol
SMILESCC1CC(O)(Cc2ccccc2)C(C)CN1C
InChIInChI=1S/C15H23NO/c1-12-11-16(3)13(2)9-15(12,17)10-14-7-5-4-6-8-14/h4-8,12-13,17H,9-11H2,1-3H3
InChIKeyYSGPBYGQFUGPJJ-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.32
Rot. Bonds2

About 4-benzyl-1,2,5-trimethylpiperidin-4-ol

4-benzyl-1,2,5-trimethylpiperidin-4-ol (PubChem CID 612649) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 4-benzyl-1,2,5-trimethylpiperidin-4-ol.

Molecular Properties

Compound Name4-benzyl-1,2,5-trimethylpiperidin-4-ol
PubChem CID612649
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name4-benzyl-1,2,5-trimethylpiperidin-4-ol
SMILESCC1CC(O)(Cc2ccccc2)C(C)CN1C
InChIInChI=1S/C15H23NO/c1-12-11-16(3)13(2)9-15(12,17)10-14-7-5-4-6-8-14/h4-8,12-13,17H,9-11H2,1-3H3
InChIKeyYSGPBYGQFUGPJJ-UHFFFAOYSA-N
XLogP2.32
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-1,2,5-trimethylpiperidin-4-ol?
The IUPAC name of 4-benzyl-1,2,5-trimethylpiperidin-4-ol (CID 612649) is 4-benzyl-1,2,5-trimethylpiperidin-4-ol.
What is the SMILES notation for 4-benzyl-1,2,5-trimethylpiperidin-4-ol?
The canonical SMILES for 4-benzyl-1,2,5-trimethylpiperidin-4-ol is CC1CC(O)(Cc2ccccc2)C(C)CN1C.
What is the InChIKey of 4-benzyl-1,2,5-trimethylpiperidin-4-ol?
The InChIKey is YSGPBYGQFUGPJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12-11-16(3)13(2)9-15(12,17)10-14-7-5-4-6-8-14/h4-8,12-13,17H,9-11H2,1-3H3.
What are the key properties of 4-benzyl-1,2,5-trimethylpiperidin-4-ol?
4-benzyl-1,2,5-trimethylpiperidin-4-ol has a molecular weight of 233.36 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-1,2,5-trimethylpiperidin-4-ol is sourced from PubChem (CID 612649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).