1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one

C18H19NO2 — CID 75219177

IUPAC1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one
SMILESCOc1ccc(N2C(=O)C(C)C2c2ccc(C)cc2)cc1
InChIInChI=1S/C18H19NO2/c1-12-4-6-14(7-5-12)17-13(2)18(20)19(17)15-8-10-16(21-3)11-9-15/h4-11,13,17H,1-3H3
InChIKeyXNFMNWWDHBKZIM-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.73
Rot. Bonds3

About 1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one

1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one (PubChem CID 75219177) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one
PubChem CID75219177
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC Name1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one
SMILESCOc1ccc(N2C(=O)C(C)C2c2ccc(C)cc2)cc1
InChIInChI=1S/C18H19NO2/c1-12-4-6-14(7-5-12)17-13(2)18(20)19(17)15-8-10-16(21-3)11-9-15/h4-11,13,17H,1-3H3
InChIKeyXNFMNWWDHBKZIM-UHFFFAOYSA-N
XLogP3.73
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S,4R)-3-methoxy-1-(4-methoxyphenyl)-4-(4-methylphenyl)azetidin-2-one
CID 102052302
(3S,4S)-3-methyl-1-(4-methylphenyl)-4-phenylazetidin-2-one
CID 154718550
(3S,4S)-1,4-bis(4-methoxyphenyl)-3-(4-methylphenyl)sulfanylazetidin-2-one
CID 154585966
(3S,4R)-3-hydroxy-1,4-bis(4-methoxyphenyl)azetidin-2-one
CID 11392395
(4R,5R)-1,3,4,5-tetrakis(4-methoxyphenyl)imidazolidin-2-one
CID 11124062
(3S,4S)-1-(4-methoxyphenyl)-3-methyl-4-[3-[(S)-(4-methylphenyl)sulfinyl]furan-2-yl]azetidin-2-one
CID 11047527
(3R,4S)-1,4-bis(4-methoxyphenyl)-3-phenylazetidin-2-one
CID 101388237
(3S,4R)-1,4-bis(4-methoxyphenyl)-3-methylsulfinylazetidin-2-one
CID 53493590
methyl (Z)-3-[[(2R,3S)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-4-oxoazetidin-3-yl]amino]but-2-enoate
CID 13331759
7,14-bis(4-methoxyphenyl)-4,11-bis(4-methylphenyl)-1,4,8,11-tetrazatetracyclo[6.6.0.02,6.09,13]tetradecane-3,5,10,12-tetrone
CID 5137894
1-(4-methoxyphenyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxylic acid
CID 171320483
2,5-bis(4-methoxyphenyl)-1,3-bis(4-methylphenyl)-2,3-dihydropyrrole
CID 90120132

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one?
The IUPAC name of 1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one (CID 75219177) is 1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one.
What is the SMILES notation for 1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one?
The canonical SMILES for 1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one is COc1ccc(N2C(=O)C(C)C2c2ccc(C)cc2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one?
The InChIKey is XNFMNWWDHBKZIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c1-12-4-6-14(7-5-12)17-13(2)18(20)19(17)15-8-10-16(21-3)11-9-15/h4-11,13,17H,1-3H3.
What are the key properties of 1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one?
1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one has a molecular weight of 281.36 g/mol, XLogP of 3.73, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one is sourced from PubChem (CID 75219177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).