N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide

C18H20Cl2N2O — CID 109006978

IUPACN-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide
SMILESCc1ccc(NCC(=O)NCCc2ccc(Cl)cc2Cl)c(C)c1
InChIInChI=1S/C18H20Cl2N2O/c1-12-3-6-17(13(2)9-12)22-11-18(23)21-8-7-14-4-5-15(19)10-16(14)20/h3-6,9-10,22H,7-8,11H2,1-2H3,(H,21,23)
InChIKeyZCANMALUUZUDSA-UHFFFAOYSA-N
MW351.28 g/mol
LogP4.38
Rot. Bonds6

About N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide

N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide (PubChem CID 109006978) has the molecular formula C18H20Cl2N2O and a molecular weight of 351.28 g/mol. Its IUPAC name is N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide.

Molecular Properties

Compound NameN-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide
PubChem CID109006978
Molecular FormulaC18H20Cl2N2O
Molecular Weight351.28 g/mol
Exact Mass350.10
IUPAC NameN-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide
SMILESCc1ccc(NCC(=O)NCCc2ccc(Cl)cc2Cl)c(C)c1
InChIInChI=1S/C18H20Cl2N2O/c1-12-3-6-17(13(2)9-12)22-11-18(23)21-8-7-14-4-5-15(19)10-16(14)20/h3-6,9-10,22H,7-8,11H2,1-2H3,(H,21,23)
InChIKeyZCANMALUUZUDSA-UHFFFAOYSA-N
XLogP4.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.28
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)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-[(2,4-dichlorophenyl)methyl]-2,4-dimethylaniline
CID 13339997
2-(4-chloro-2-methylanilino)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 37476152
N-butyl-2-(4-chloro-2-methylanilino)acetamide
CID 108993148
N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,6-difluoroanilino)acetamide
CID 109007030
2-(4-chlorophenyl)-N'-[2-(2,4-dimethylanilino)acetyl]acetohydrazide
CID 7923263
2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide
CID 109007008
N-[(2,4-dichlorophenyl)methylideneamino]-2-(2,4-dimethylanilino)acetamide
CID 4630450
2-(2-chloro-4-methylanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 9099362
2-(4-chloro-2-methylanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 26507073
2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide
CID 113167737
2-[2-(2,4-dichlorophenyl)ethylamino]-N-ethylacetamide
CID 28578887
N-butyl-2-[2-(2,4-dichlorophenyl)ethylamino]acetamide
CID 60672273

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide?
The IUPAC name of N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide (CID 109006978) is N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide.
What is the SMILES notation for N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide?
The canonical SMILES for N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide is Cc1ccc(NCC(=O)NCCc2ccc(Cl)cc2Cl)c(C)c1.
What is the InChIKey of N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide?
The InChIKey is ZCANMALUUZUDSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20Cl2N2O/c1-12-3-6-17(13(2)9-12)22-11-18(23)21-8-7-14-4-5-15(19)10-16(14)20/h3-6,9-10,22H,7-8,11H2,1-2H3,(H,21,23).
What are the key properties of N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide?
N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide has a molecular weight of 351.28 g/mol, XLogP of 4.38, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide is sourced from PubChem (CID 109006978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).