1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol

C9H19NO2 — CID 122614507

IUPAC1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol
SMILESCC(O)C1CCCCN1C(C)O
InChIInChI=1S/C9H19NO2/c1-7(11)9-5-3-4-6-10(9)8(2)12/h7-9,11-12H,3-6H2,1-2H3
InChIKeyHLGKZFOJNYVKGS-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.56
Rot. Bonds2

About 1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol

1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol (PubChem CID 122614507) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol.

Molecular Properties

Compound Name1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol
PubChem CID122614507
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol
SMILESCC(O)C1CCCCN1C(C)O
InChIInChI=1S/C9H19NO2/c1-7(11)9-5-3-4-6-10(9)8(2)12/h7-9,11-12H,3-6H2,1-2H3
InChIKeyHLGKZFOJNYVKGS-UHFFFAOYSA-N
XLogP0.56
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol?
The IUPAC name of 1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol (CID 122614507) is 1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol.
What is the SMILES notation for 1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol?
The canonical SMILES for 1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol is CC(O)C1CCCCN1C(C)O.
What is the InChIKey of 1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol?
The InChIKey is HLGKZFOJNYVKGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-7(11)9-5-3-4-6-10(9)8(2)12/h7-9,11-12H,3-6H2,1-2H3.
What are the key properties of 1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol?
1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol has a molecular weight of 173.26 g/mol, XLogP of 0.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-hydroxyethyl)piperidin-2-yl]ethanol is sourced from PubChem (CID 122614507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).