N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide

C25H24N2O5 — CID 57283520

IUPACN-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide
SMILESCOc1ccc(N2C(=O)C(NC(=O)COc3ccccc3)C2c2ccccc2)cc1OC
InChIInChI=1S/C25H24N2O5/c1-30-20-14-13-18(15-21(20)31-2)27-24(17-9-5-3-6-10-17)23(25(27)29)26-22(28)16-32-19-11-7-4-8-12-19/h3-15,23-24H,16H2,1-2H3,(H,26,28)
InChIKeyNSSHQVLBFGZAIW-UHFFFAOYSA-N
MW432.48 g/mol
LogP3.36
Rot. Bonds8

About N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide

N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide (PubChem CID 57283520) has the molecular formula C25H24N2O5 and a molecular weight of 432.48 g/mol. Its IUPAC name is N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide
PubChem CID57283520
Molecular FormulaC25H24N2O5
Molecular Weight432.48 g/mol
Exact Mass432.17
IUPAC NameN-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide
SMILESCOc1ccc(N2C(=O)C(NC(=O)COc3ccccc3)C2c2ccccc2)cc1OC
InChIInChI=1S/C25H24N2O5/c1-30-20-14-13-18(15-21(20)31-2)27-24(17-9-5-3-6-10-17)23(25(27)29)26-22(28)16-32-19-11-7-4-8-12-19/h3-15,23-24H,16H2,1-2H3,(H,26,28)
InChIKeyNSSHQVLBFGZAIW-UHFFFAOYSA-N
XLogP3.36
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.48
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-(2-phenylethenyl)azetidin-3-yl]-2-phenoxyacetamide
CID 57212043
methyl (5R,6R)-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
CID 70548710
(2S)-4-(3,4-dimethoxyanilino)-1-(3,4-dimethoxyphenyl)-2-phenyl-2H-pyrrol-5-one
CID 124529511
methyl (E)-3-[[1-(4-methoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]amino]but-2-enoate
CID 70575634
sodium 3-methoxy-7-oxo-6-[(2-phenoxyacetyl)amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
CID 23670465
(4S,6S)-4-methoxy-3-methyl-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CID 57051575
methyl 3-[[(3R,4S)-2-oxo-1,4-diphenylazetidin-3-yl]amino]but-2-enoate
CID 70577054
methyl (1R,3R,4R)-11-hydroxy-10-methyl-5-oxo-4-[(2-phenoxyacetyl)amino]-2-thia-6-azatricyclo[6.3.0.03,6]undeca-7,9-diene-7-carboxylate
CID 10454571
2-(4-chlorophenoxy)-N-[(3R)-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 7564324
(6R,7R)-3-methoxy-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid
CID 70560009
N-[(2S,3R)-1-[(2,4-dimethoxyphenyl)methyl]-2-[2-(1,3-dioxolan-2-yl)phenyl]-4-oxoazetidin-3-yl]-2-phenoxyacetamide
CID 70584365
methyl (6R,7R)-8-oxo-7-[(2-phenoxyacetyl)amino]-3-[(triphenyl-λ5-phosphanylidene)methyl]-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate
CID 11758602

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide?
The IUPAC name of N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide (CID 57283520) is N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide.
What is the SMILES notation for N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide?
The canonical SMILES for N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide is COc1ccc(N2C(=O)C(NC(=O)COc3ccccc3)C2c2ccccc2)cc1OC.
What is the InChIKey of N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide?
The InChIKey is NSSHQVLBFGZAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O5/c1-30-20-14-13-18(15-21(20)31-2)27-24(17-9-5-3-6-10-17)23(25(27)29)26-22(28)16-32-19-11-7-4-8-12-19/h3-15,23-24H,16H2,1-2H3,(H,26,28).
What are the key properties of N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide?
N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide has a molecular weight of 432.48 g/mol, XLogP of 3.36, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,4-dimethoxyphenyl)-2-oxo-4-phenylazetidin-3-yl]-2-phenoxyacetamide is sourced from PubChem (CID 57283520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).