2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide

C12H16Cl2N2O — CID 28578887

IUPAC2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide
SMILESCCNC(=O)CNCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C12H16Cl2N2O/c1-2-16-12(17)8-15-6-5-9-3-4-10(13)7-11(9)14/h3-4,7,15H,2,5-6,8H2,1H3,(H,16,17)
InChIKeyUIFVFJVCJZVNDR-UHFFFAOYSA-N
MW275.18 g/mol
LogP2.26
Rot. Bonds6

About 2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide

2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide (PubChem CID 28578887) has the molecular formula C12H16Cl2N2O and a molecular weight of 275.18 g/mol. Its IUPAC name is 2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide.

Molecular Properties

Compound Name2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide
PubChem CID28578887
Molecular FormulaC12H16Cl2N2O
Molecular Weight275.18 g/mol
Exact Mass274.06
IUPAC Name2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide
SMILESCCNC(=O)CNCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C12H16Cl2N2O/c1-2-16-12(17)8-15-6-5-9-3-4-10(13)7-11(9)14/h3-4,7,15H,2,5-6,8H2,1H3,(H,16,17)
InChIKeyUIFVFJVCJZVNDR-UHFFFAOYSA-N
XLogP2.26
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.18
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide 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-butyl-2-[2-(2,4-dichlorophenyl)ethylamino]acetamide
CID 60672273
2-[(2,4-dichlorophenyl)methylamino]-N-ethylacetamide
CID 43399947
2-[2-(2,4-dichlorophenyl)ethylamino]-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 109000291
N-[2-(3-chlorophenyl)ethyl]-2-[2-(2,4-dichlorophenyl)ethylamino]acetamide
CID 109006805
N-[2-(2,4-dichlorophenyl)ethyl]-2-[2-(2-fluorophenyl)ethylamino]acetamide
CID 109000163
ethyl 2-[2-(2,4-dichlorophenyl)ethylamino]acetate
CID 28578934
2-[2-(2,4-dichlorophenyl)ethylamino]-N-[2-(4-methoxyphenoxy)ethyl]acetamide
CID 109005315
2-[2-(2,4-dichlorophenyl)ethylamino]-N-(2-methylphenyl)acetamide
CID 109006897
1-[2-(2,4-dichlorophenyl)ethyl]-3-propylurea
CID 47103763
2-[2-(2,4-dichlorophenyl)ethylamino]-N-(4-fluorophenyl)acetamide
CID 109006915
2-[2-(cyclohexen-1-yl)ethylamino]-N-[2-(2,4-dichlorophenyl)ethyl]acetamide
CID 108993859
N-[2-(2,4-dichlorophenyl)ethyl]-3-(ethylamino)-2-methylpropanamide
CID 62853416

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide?
The IUPAC name of 2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide (CID 28578887) is 2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide.
What is the SMILES notation for 2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide?
The canonical SMILES for 2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide is CCNC(=O)CNCCc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide?
The InChIKey is UIFVFJVCJZVNDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16Cl2N2O/c1-2-16-12(17)8-15-6-5-9-3-4-10(13)7-11(9)14/h3-4,7,15H,2,5-6,8H2,1H3,(H,16,17).
What are the key properties of 2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide?
2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide has a molecular weight of 275.18 g/mol, XLogP of 2.26, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide is sourced from PubChem (CID 28578887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).