4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one

C18H19NO3 — CID 10924467

IUPAC4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one
SMILESCOc1cccc(CN2C(=O)CC2c2cccc(OC)c2)c1
InChIInChI=1S/C18H19NO3/c1-21-15-7-3-5-13(9-15)12-19-17(11-18(19)20)14-6-4-8-16(10-14)22-2/h3-10,17H,11-12H2,1-2H3
InChIKeyNFICBYQPSINJRK-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.18
Rot. Bonds5

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

4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one (PubChem CID 10924467) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one
PubChem CID10924467
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Name4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one
SMILESCOc1cccc(CN2C(=O)CC2c2cccc(OC)c2)c1
InChIInChI=1S/C18H19NO3/c1-21-15-7-3-5-13(9-15)12-19-17(11-18(19)20)14-6-4-8-16(10-14)22-2/h3-10,17H,11-12H2,1-2H3
InChIKeyNFICBYQPSINJRK-UHFFFAOYSA-N
XLogP3.18
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-4-phenylazetidin-2-one;ethane
CID 91301101
1-[(3-methoxyphenyl)methyl]-4-sulfanylpyrrolidin-2-one
CID 168708642
3-[(3-methoxyphenyl)methyl]-2-(1H-pyrrol-2-yl)-1,3-thiazinan-4-one
CID 3742714
(5S)-5-ethenyl-1-[(3-methoxyphenyl)methyl]pyrrolidin-2-one
CID 57242076
1-benzyl-5-(3-methoxyphenyl)-4,5-dihydroimidazol-2-amine
CID 79498168
(4S,5S,6R)-6-(4-hydroxyphenyl)-1-[(3-methoxyphenyl)methyl]-5-nitro-4-phenylpiperidin-2-one
CID 127032375
1-[(3-methoxyphenyl)methyl]piperazine-2,6-dione
CID 66063818
(3S)-1-[(3-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid
CID 9146852
3-amino-1-benzyl-4-(3-methoxyphenyl)azetidin-2-one
CID 102537099
3-[(3-methoxyphenyl)methyl]-2-oxo-1,3-oxazolidine-4-carboxylic acid
CID 82481104
methyl 3-[[2-(3-methoxyphenyl)pyrrolidin-1-yl]methyl]benzoate
CID 56906374
(2R)-4-hydroxy-1-[(3-methoxyphenyl)methyl]-2,3-diphenyl-2H-pyrrol-5-one
CID 94072924

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one?
The IUPAC name of 4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one (CID 10924467) is 4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one.
What is the SMILES notation for 4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one?
The canonical SMILES for 4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one is COc1cccc(CN2C(=O)CC2c2cccc(OC)c2)c1.
What is the InChIKey of 4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one?
The InChIKey is NFICBYQPSINJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-21-15-7-3-5-13(9-15)12-19-17(11-18(19)20)14-6-4-8-16(10-14)22-2/h3-10,17H,11-12H2,1-2H3.
What are the key properties of 4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one?
4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one has a molecular weight of 297.35 g/mol, XLogP of 3.18, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]azetidin-2-one is sourced from PubChem (CID 10924467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).