1-(2-hydroxyethyl)piperidin-4-one

C7H13NO2 — CID 15006446

IUPAC1-(2-hydroxyethyl)piperidin-4-one
SMILESO=C1CCN(CCO)CC1
InChIInChI=1S/C7H13NO2/c9-6-5-8-3-1-7(10)2-4-8/h9H,1-6H2
InChIKeyUIFFSBYMUXSQNX-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.36
Rot. Bonds2

About 1-(2-hydroxyethyl)piperidin-4-one

1-(2-hydroxyethyl)piperidin-4-one (PubChem CID 15006446) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)piperidin-4-one.

Molecular Properties

Compound Name1-(2-hydroxyethyl)piperidin-4-one
PubChem CID15006446
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name1-(2-hydroxyethyl)piperidin-4-one
SMILESO=C1CCN(CCO)CC1
InChIInChI=1S/C7H13NO2/c9-6-5-8-3-1-7(10)2-4-8/h9H,1-6H2
InChIKeyUIFFSBYMUXSQNX-UHFFFAOYSA-N
XLogP-0.36
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)piperidin-4-one?
The IUPAC name of 1-(2-hydroxyethyl)piperidin-4-one (CID 15006446) is 1-(2-hydroxyethyl)piperidin-4-one.
What is the SMILES notation for 1-(2-hydroxyethyl)piperidin-4-one?
The canonical SMILES for 1-(2-hydroxyethyl)piperidin-4-one is O=C1CCN(CCO)CC1.
What is the InChIKey of 1-(2-hydroxyethyl)piperidin-4-one?
The InChIKey is UIFFSBYMUXSQNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c9-6-5-8-3-1-7(10)2-4-8/h9H,1-6H2.
What are the key properties of 1-(2-hydroxyethyl)piperidin-4-one?
1-(2-hydroxyethyl)piperidin-4-one has a molecular weight of 143.19 g/mol, XLogP of -0.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)piperidin-4-one is sourced from PubChem (CID 15006446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).