1-(oxetan-3-yl)-4-propylpiperidin-4-ol

C11H21NO2 — CID 145006365

IUPAC1-(oxetan-3-yl)-4-propylpiperidin-4-ol
SMILESCCCC1(O)CCN(C2COC2)CC1
InChIInChI=1S/C11H21NO2/c1-2-3-11(13)4-6-12(7-5-11)10-8-14-9-10/h10,13H,2-9H2,1H3
InChIKeyAJVZODPMFVDFRL-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.01
Rot. Bonds3

About 1-(oxetan-3-yl)-4-propylpiperidin-4-ol

1-(oxetan-3-yl)-4-propylpiperidin-4-ol (PubChem CID 145006365) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 1-(oxetan-3-yl)-4-propylpiperidin-4-ol.

Molecular Properties

Compound Name1-(oxetan-3-yl)-4-propylpiperidin-4-ol
PubChem CID145006365
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name1-(oxetan-3-yl)-4-propylpiperidin-4-ol
SMILESCCCC1(O)CCN(C2COC2)CC1
InChIInChI=1S/C11H21NO2/c1-2-3-11(13)4-6-12(7-5-11)10-8-14-9-10/h10,13H,2-9H2,1H3
InChIKeyAJVZODPMFVDFRL-UHFFFAOYSA-N
XLogP1.01
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(oxetan-3-yl)-4-propylpiperidin-4-ol?
The IUPAC name of 1-(oxetan-3-yl)-4-propylpiperidin-4-ol (CID 145006365) is 1-(oxetan-3-yl)-4-propylpiperidin-4-ol.
What is the SMILES notation for 1-(oxetan-3-yl)-4-propylpiperidin-4-ol?
The canonical SMILES for 1-(oxetan-3-yl)-4-propylpiperidin-4-ol is CCCC1(O)CCN(C2COC2)CC1.
What is the InChIKey of 1-(oxetan-3-yl)-4-propylpiperidin-4-ol?
The InChIKey is AJVZODPMFVDFRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-2-3-11(13)4-6-12(7-5-11)10-8-14-9-10/h10,13H,2-9H2,1H3.
What are the key properties of 1-(oxetan-3-yl)-4-propylpiperidin-4-ol?
1-(oxetan-3-yl)-4-propylpiperidin-4-ol has a molecular weight of 199.29 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxetan-3-yl)-4-propylpiperidin-4-ol is sourced from PubChem (CID 145006365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).