3-amino-4-(4-methoxyphenyl)azetidin-2-one

C10H12N2O2 — CID 82402822

IUPAC3-amino-4-(4-methoxyphenyl)azetidin-2-one
SMILESCOc1ccc(C2NC(=O)C2N)cc1
InChIInChI=1S/C10H12N2O2/c1-14-7-4-2-6(3-5-7)9-8(11)10(13)12-9/h2-5,8-9H,11H2,1H3,(H,12,13)
InChIKeyRFOFWIZNZVIZES-UHFFFAOYSA-N
MW192.22 g/mol
LogP0.19
Rot. Bonds2

About 3-amino-4-(4-methoxyphenyl)azetidin-2-one

3-amino-4-(4-methoxyphenyl)azetidin-2-one (PubChem CID 82402822) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 3-amino-4-(4-methoxyphenyl)azetidin-2-one.

Molecular Properties

Compound Name3-amino-4-(4-methoxyphenyl)azetidin-2-one
PubChem CID82402822
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name3-amino-4-(4-methoxyphenyl)azetidin-2-one
SMILESCOc1ccc(C2NC(=O)C2N)cc1
InChIInChI=1S/C10H12N2O2/c1-14-7-4-2-6(3-5-7)9-8(11)10(13)12-9/h2-5,8-9H,11H2,1H3,(H,12,13)
InChIKeyRFOFWIZNZVIZES-UHFFFAOYSA-N
XLogP0.19
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-5-(4-methoxyphenyl)-3-methylpyrrolidin-2-one
CID 154983197
(3S,4S)-3-chloro-4-(4-methoxyphenyl)azetidin-2-one
CID 11171849
(2R,3R)-2-(4-methoxyphenyl)-3-methyl-2,3-dihydro-1H-pyridin-6-one
CID 10330960
(3S)-3-(4-methoxyphenyl)pyrrolidin-2-one
CID 94827666
(3R,4S)-4-(4-methoxyphenyl)-3-phenylmethoxyazetidin-2-one
CID 10379085
[(2R,3S,4S)-2-(4-methoxyphenyl)-4-methyl-5-oxopyrrolidin-3-yl]carbamic acid
CID 154983238
(3S,6S)-6-(4-methoxyphenyl)-3-methylpiperidin-2-one
CID 177493796
(2R,3R,5S,6S)-2,6-bis(4-methoxyphenyl)-3,5-diphenylpiperidin-4-one
CID 40806325
2,6-bis(4-methoxyphenyl)-1-methylpiperidin-4-one
CID 14047057
(1E,7E)-5,12-bis(4-methoxyphenyl)-6,7,13,14-tetramethyl-1,2,4,8,9,11-hexazacyclotetradeca-7,14-diene-3,10-dione
CID 177442101
ethyl (4R,5S)-4-(4-methoxyphenyl)-2-oxo-1,3-oxazolidine-5-carboxylate
CID 11230866
6-(4-methoxyphenyl)-1,2,4,5-tetrazinan-3-one
CID 24829281

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-(4-methoxyphenyl)azetidin-2-one?
The IUPAC name of 3-amino-4-(4-methoxyphenyl)azetidin-2-one (CID 82402822) is 3-amino-4-(4-methoxyphenyl)azetidin-2-one.
What is the SMILES notation for 3-amino-4-(4-methoxyphenyl)azetidin-2-one?
The canonical SMILES for 3-amino-4-(4-methoxyphenyl)azetidin-2-one is COc1ccc(C2NC(=O)C2N)cc1.
What is the InChIKey of 3-amino-4-(4-methoxyphenyl)azetidin-2-one?
The InChIKey is RFOFWIZNZVIZES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-14-7-4-2-6(3-5-7)9-8(11)10(13)12-9/h2-5,8-9H,11H2,1H3,(H,12,13).
What are the key properties of 3-amino-4-(4-methoxyphenyl)azetidin-2-one?
3-amino-4-(4-methoxyphenyl)azetidin-2-one has a molecular weight of 192.22 g/mol, XLogP of 0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-(4-methoxyphenyl)azetidin-2-one is sourced from PubChem (CID 82402822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).