1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone

C10H19NO2 — CID 538237

IUPAC1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone
SMILESCCCC1CCC(O)CN1C(C)=O
InChIInChI=1S/C10H19NO2/c1-3-4-9-5-6-10(13)7-11(9)8(2)12/h9-10,13H,3-7H2,1-2H3
InChIKeyMMZIMNFISYOWRF-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.16
Rot. Bonds2

About 1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone

1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone (PubChem CID 538237) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone
PubChem CID538237
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone
SMILESCCCC1CCC(O)CN1C(C)=O
InChIInChI=1S/C10H19NO2/c1-3-4-9-5-6-10(13)7-11(9)8(2)12/h9-10,13H,3-7H2,1-2H3
InChIKeyMMZIMNFISYOWRF-UHFFFAOYSA-N
XLogP1.16
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone?
The IUPAC name of 1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone (CID 538237) is 1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone.
What is the SMILES notation for 1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone?
The canonical SMILES for 1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone is CCCC1CCC(O)CN1C(C)=O.
What is the InChIKey of 1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone?
The InChIKey is MMZIMNFISYOWRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-4-9-5-6-10(13)7-11(9)8(2)12/h9-10,13H,3-7H2,1-2H3.
What are the key properties of 1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone?
1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone has a molecular weight of 185.27 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-hydroxy-2-propylpiperidin-1-yl)ethanone is sourced from PubChem (CID 538237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).