azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone

C8H11NO2 — CID 102652521

IUPACazetidin-3-yl(2,3-dihydrofuran-5-yl)methanone
SMILESO=C(C1=CCCO1)C1CNC1
InChIInChI=1S/C8H11NO2/c10-8(6-4-9-5-6)7-2-1-3-11-7/h2,6,9H,1,3-5H2
InChIKeyOQZSNCHNNJTXHH-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.08
Rot. Bonds2

About azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone

azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone (PubChem CID 102652521) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone.

Molecular Properties

Compound Nameazetidin-3-yl(2,3-dihydrofuran-5-yl)methanone
PubChem CID102652521
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Nameazetidin-3-yl(2,3-dihydrofuran-5-yl)methanone
SMILESO=C(C1=CCCO1)C1CNC1
InChIInChI=1S/C8H11NO2/c10-8(6-4-9-5-6)7-2-1-3-11-7/h2,6,9H,1,3-5H2
InChIKeyOQZSNCHNNJTXHH-UHFFFAOYSA-N
XLogP0.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone?
The IUPAC name of azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone (CID 102652521) is azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone.
What is the SMILES notation for azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone?
The canonical SMILES for azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone is O=C(C1=CCCO1)C1CNC1.
What is the InChIKey of azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone?
The InChIKey is OQZSNCHNNJTXHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c10-8(6-4-9-5-6)7-2-1-3-11-7/h2,6,9H,1,3-5H2.
What are the key properties of azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone?
azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone has a molecular weight of 153.18 g/mol, XLogP of 0.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-3-yl(2,3-dihydrofuran-5-yl)methanone is sourced from PubChem (CID 102652521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).