2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone

C11H19NO3 — CID 103164675

IUPAC2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone
SMILESCCOC1CC(CC(=O)N2CC(O)C2)C1
InChIInChI=1S/C11H19NO3/c1-2-15-10-3-8(4-10)5-11(14)12-6-9(13)7-12/h8-10,13H,2-7H2,1H3
InChIKeyKAMKIBNSNXOGCI-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.39
Rot. Bonds4

About 2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone

2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone (PubChem CID 103164675) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone
PubChem CID103164675
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone
SMILESCCOC1CC(CC(=O)N2CC(O)C2)C1
InChIInChI=1S/C11H19NO3/c1-2-15-10-3-8(4-10)5-11(14)12-6-9(13)7-12/h8-10,13H,2-7H2,1H3
InChIKeyKAMKIBNSNXOGCI-UHFFFAOYSA-N
XLogP0.39
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-ethoxycyclobutyl)-1-piperidin-1-ylethanone
CID 103164590
1-(3-chloropyrrolidin-1-yl)-2-(3-ethoxycyclobutyl)ethanone
CID 103166618
2-(3-ethoxycyclobutyl)-1-(3-methylpiperazin-1-yl)ethanone
CID 103162209
1-[2-(3-ethoxycyclobutyl)acetyl]pyrrolidine-3-carboxylic acid
CID 103161885
1-(3-amino-3-propylazetidin-1-yl)-2-(3-ethoxycyclobutyl)ethanone
CID 103166996
1-[3-(chloromethyl)piperidin-1-yl]-2-(3-ethoxycyclobutyl)ethanone
CID 103166602
1-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-2-(3-ethoxycyclobutyl)ethanone
CID 103165089
1-[4-(1-aminoethyl)piperidin-1-yl]-2-(3-ethoxycyclobutyl)ethanone
CID 103164939
2-(3-ethoxycyclobutyl)-1-[3-methyl-4-(methylamino)piperidin-1-yl]ethanone
CID 103161328
methyl 4-[2-(3-ethoxycyclobutyl)acetyl]morpholine-2-carboxylate
CID 103165176
2-[4-[2-(3-ethoxycyclobutyl)acetyl]piperazin-1-yl]propanenitrile
CID 103163584
2-[4-[2-(3-ethoxycyclobutyl)acetyl]piperazin-1-yl]-2-methylpropanenitrile
CID 103163589

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone?
The IUPAC name of 2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone (CID 103164675) is 2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone.
What is the SMILES notation for 2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone?
The canonical SMILES for 2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone is CCOC1CC(CC(=O)N2CC(O)C2)C1.
What is the InChIKey of 2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone?
The InChIKey is KAMKIBNSNXOGCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-2-15-10-3-8(4-10)5-11(14)12-6-9(13)7-12/h8-10,13H,2-7H2,1H3.
What are the key properties of 2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone?
2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone has a molecular weight of 213.28 g/mol, XLogP of 0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone is sourced from PubChem (CID 103164675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).