1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol

C15H23NO — CID 55061562

IUPAC1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol
SMILESCC1CCN(c2ccccc2C(C)O)C(C)C1
InChIInChI=1S/C15H23NO/c1-11-8-9-16(12(2)10-11)15-7-5-4-6-14(15)13(3)17/h4-7,11-13,17H,8-10H2,1-3H3
InChIKeyGNFKDXPOMNVFEO-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.36
Rot. Bonds2

About 1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol

1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol (PubChem CID 55061562) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol.

Molecular Properties

Compound Name1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol
PubChem CID55061562
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol
SMILESCC1CCN(c2ccccc2C(C)O)C(C)C1
InChIInChI=1S/C15H23NO/c1-11-8-9-16(12(2)10-11)15-7-5-4-6-14(15)13(3)17/h4-7,11-13,17H,8-10H2,1-3H3
InChIKeyGNFKDXPOMNVFEO-UHFFFAOYSA-N
XLogP3.36
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 ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol?
The IUPAC name of 1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol (CID 55061562) is 1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol.
What is the SMILES notation for 1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol?
The canonical SMILES for 1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol is CC1CCN(c2ccccc2C(C)O)C(C)C1.
What is the InChIKey of 1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol?
The InChIKey is GNFKDXPOMNVFEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-11-8-9-16(12(2)10-11)15-7-5-4-6-14(15)13(3)17/h4-7,11-13,17H,8-10H2,1-3H3.
What are the key properties of 1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol?
1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol has a molecular weight of 233.36 g/mol, XLogP of 3.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol is sourced from PubChem (CID 55061562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).