N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide

C18H18Cl2N2O5 — CID 3910876

IUPACN-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide
SMILESCOc1ccc(NC(=O)COCC(=O)Nc2cccc(Cl)c2Cl)c(OC)c1
InChIInChI=1S/C18H18Cl2N2O5/c1-25-11-6-7-13(15(8-11)26-2)21-16(23)9-27-10-17(24)22-14-5-3-4-12(19)18(14)20/h3-8H,9-10H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyXRKXXKQXGGQAIQ-UHFFFAOYSA-N
MW413.26 g/mol
LogP3.60
Rot. Bonds8

About N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide

N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide (PubChem CID 3910876) has the molecular formula C18H18Cl2N2O5 and a molecular weight of 413.26 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide
PubChem CID3910876
Molecular FormulaC18H18Cl2N2O5
Molecular Weight413.26 g/mol
Exact Mass412.06
IUPAC NameN-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide
SMILESCOc1ccc(NC(=O)COCC(=O)Nc2cccc(Cl)c2Cl)c(OC)c1
InChIInChI=1S/C18H18Cl2N2O5/c1-25-11-6-7-13(15(8-11)26-2)21-16(23)9-27-10-17(24)22-14-5-3-4-12(19)18(14)20/h3-8H,9-10H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyXRKXXKQXGGQAIQ-UHFFFAOYSA-N
XLogP3.60
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.26
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide 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-(2,3-dichlorophenyl)-2,4-dimethoxybenzamide
CID 789234
N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide
CID 110678307
2-[2-(2,3-dichloroanilino)-2-oxoethoxy]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
CID 5135119
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,3-dichlorophenyl)acetamide
CID 113174648
[2-(2,3-dichloroanilino)-2-oxoethyl] 2-hydroxy-5-methoxybenzoate
CID 18085533
N-(2,4-dimethoxyphenyl)-2-(2,4,6-trichlorophenoxy)acetamide
CID 7275265
N-(2,4-dimethoxyphenyl)-2-[2-oxo-2-(N-phenylanilino)ethoxy]acetamide
CID 3376668
N-(2,4-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 868059
2-(3,5-dichlorophenoxy)-N-(2,4-dimethoxyphenyl)acetamide
CID 7467088
N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide
CID 110777937
[2-(2,3-dichloroanilino)-2-oxoethyl] (3R)-1-(2,5-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxylate
CID 38248101
2-chloro-N-(2,4-dimethoxyphenyl)benzamide
CID 722324

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide (CID 3910876) is N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide is COc1ccc(NC(=O)COCC(=O)Nc2cccc(Cl)c2Cl)c(OC)c1.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide?
The InChIKey is XRKXXKQXGGQAIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O5/c1-25-11-6-7-13(15(8-11)26-2)21-16(23)9-27-10-17(24)22-14-5-3-4-12(19)18(14)20/h3-8H,9-10H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide?
N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide has a molecular weight of 413.26 g/mol, XLogP of 3.60, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide is sourced from PubChem (CID 3910876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).