4-(3,4-dimethoxyphenyl)azetidin-2-one

C11H13NO3 — CID 64667069

IUPAC4-(3,4-dimethoxyphenyl)azetidin-2-one
SMILESCOc1ccc(C2CC(=O)N2)cc1OC
InChIInChI=1S/C11H13NO3/c1-14-9-4-3-7(5-10(9)15-2)8-6-11(13)12-8/h3-5,8H,6H2,1-2H3,(H,12,13)
InChIKeySJYUEYCMIONTJS-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.26
Rot. Bonds3

About 4-(3,4-dimethoxyphenyl)azetidin-2-one

4-(3,4-dimethoxyphenyl)azetidin-2-one (PubChem CID 64667069) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is 4-(3,4-dimethoxyphenyl)azetidin-2-one.

Molecular Properties

Compound Name4-(3,4-dimethoxyphenyl)azetidin-2-one
PubChem CID64667069
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Name4-(3,4-dimethoxyphenyl)azetidin-2-one
SMILESCOc1ccc(C2CC(=O)N2)cc1OC
InChIInChI=1S/C11H13NO3/c1-14-9-4-3-7(5-10(9)15-2)8-6-11(13)12-8/h3-5,8H,6H2,1-2H3,(H,12,13)
InChIKeySJYUEYCMIONTJS-UHFFFAOYSA-N
XLogP1.26
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3,4-dimethoxyphenyl)pyrazolidin-3-one
CID 22046088
(5R)-5-(3,4-dimethoxyphenyl)piperazin-2-one
CID 97015434
4-(3,4-diethoxyphenyl)azetidin-2-one
CID 131885056
6-(3,4-dimethoxyphenyl)-3-(2-methylpropyl)piperidine-2,4-dione
CID 58531813
(6S)-6-(3,4-dimethoxyphenyl)-6,7-dihydro-5H-[1,3]dioxolo[4,5-g]quinolin-8-one
CID 97045976
4-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolidin-2-one
CID 5092
4-(2-methoxy-5-methylphenyl)azetidin-2-one
CID 66350975
(1S,3aS,4S,6aS)-1,4-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydropentalene-2,5-dione
CID 10364225
3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
CID 10882055
(2S)-2-(3,4-dimethoxyphenyl)piperidine;hydrochloride
CID 171194815
4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyridazin-6-one
CID 15521373
2-(3,4-dimethoxyphenyl)-5-(2-methylpropyl)piperidin-4-ol;6-(3,4-dimethoxyphenyl)piperidine-2,4-dione
CID 162092077

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dimethoxyphenyl)azetidin-2-one?
The IUPAC name of 4-(3,4-dimethoxyphenyl)azetidin-2-one (CID 64667069) is 4-(3,4-dimethoxyphenyl)azetidin-2-one.
What is the SMILES notation for 4-(3,4-dimethoxyphenyl)azetidin-2-one?
The canonical SMILES for 4-(3,4-dimethoxyphenyl)azetidin-2-one is COc1ccc(C2CC(=O)N2)cc1OC.
What is the InChIKey of 4-(3,4-dimethoxyphenyl)azetidin-2-one?
The InChIKey is SJYUEYCMIONTJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c1-14-9-4-3-7(5-10(9)15-2)8-6-11(13)12-8/h3-5,8H,6H2,1-2H3,(H,12,13).
What are the key properties of 4-(3,4-dimethoxyphenyl)azetidin-2-one?
4-(3,4-dimethoxyphenyl)azetidin-2-one has a molecular weight of 207.23 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dimethoxyphenyl)azetidin-2-one is sourced from PubChem (CID 64667069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).