2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide

C16H23Cl2N3O3 — CID 78827820

IUPAC2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide
SMILESCCN(CC(=O)NCCCOC)CC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C16H23Cl2N3O3/c1-3-21(10-14(22)19-8-5-9-24-2)11-15(23)20-16-12(17)6-4-7-13(16)18/h4,6-7H,3,5,8-11H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyWSCYGDUVAUOPMP-UHFFFAOYSA-N
MW376.28 g/mol
LogP2.41
Rot. Bonds10

About 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide

2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide (PubChem CID 78827820) has the molecular formula C16H23Cl2N3O3 and a molecular weight of 376.28 g/mol. Its IUPAC name is 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide.

Molecular Properties

Compound Name2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide
PubChem CID78827820
Molecular FormulaC16H23Cl2N3O3
Molecular Weight376.28 g/mol
Exact Mass375.11
IUPAC Name2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide
SMILESCCN(CC(=O)NCCCOC)CC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C16H23Cl2N3O3/c1-3-21(10-14(22)19-8-5-9-24-2)11-15(23)20-16-12(17)6-4-7-13(16)18/h4,6-7H,3,5,8-11H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyWSCYGDUVAUOPMP-UHFFFAOYSA-N
XLogP2.41
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.28
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)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'-(2,6-dichlorophenyl)-N-(3-methoxypropyl)propanediamide
CID 108943408
2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-[(2-methoxyphenyl)methyl]acetamide
CID 41445035
2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-phenylacetamide
CID 34925634
2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide
CID 78787360
1-N-(2,6-dichlorophenyl)-2-N-(3-methoxypropyl)cyclopropane-1,2-dicarboxamide
CID 109133253
2-chloro-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N-methylbenzamide
CID 51307796
N-(2,6-dichlorophenyl)-3-[[2-oxo-2-(propylamino)ethyl]-propylamino]propanamide
CID 87018474
2-chloro-6-fluoro-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N-methylbenzamide
CID 51307804
2-[acetyl-[(2-chlorophenyl)methyl]amino]-N-(3-methoxypropyl)acetamide
CID 113162526
2-[carboxymethyl-[2-(2,6-dichloroanilino)-2-oxoethyl]amino]acetic acid
CID 63646991
N-(2,6-dichlorophenyl)-2-(dimethylamino)acetamide
CID 9255062
2-(2-bromo-3-chloroanilino)-N-(3-methoxypropyl)acetamide
CID 103478891

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide?
The IUPAC name of 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide (CID 78827820) is 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide.
What is the SMILES notation for 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide?
The canonical SMILES for 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide is CCN(CC(=O)NCCCOC)CC(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide?
The InChIKey is WSCYGDUVAUOPMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23Cl2N3O3/c1-3-21(10-14(22)19-8-5-9-24-2)11-15(23)20-16-12(17)6-4-7-13(16)18/h4,6-7H,3,5,8-11H2,1-2H3,(H,19,22)(H,20,23).
What are the key properties of 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide?
2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide has a molecular weight of 376.28 g/mol, XLogP of 2.41, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide is sourced from PubChem (CID 78827820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).