N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide

C18H21ClN2O — CID 32908644

IUPACN-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide
SMILESCc1cccc(C)c1NCC(=O)NCCc1cccc(Cl)c1
InChIInChI=1S/C18H21ClN2O/c1-13-5-3-6-14(2)18(13)21-12-17(22)20-10-9-15-7-4-8-16(19)11-15/h3-8,11,21H,9-10,12H2,1-2H3,(H,20,22)
InChIKeyAMWUCEFFJGZPJC-UHFFFAOYSA-N
MW316.83 g/mol
LogP3.73
Rot. Bonds6

About N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide

N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide (PubChem CID 32908644) has the molecular formula C18H21ClN2O and a molecular weight of 316.83 g/mol. Its IUPAC name is N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide.

Molecular Properties

Compound NameN-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide
PubChem CID32908644
Molecular FormulaC18H21ClN2O
Molecular Weight316.83 g/mol
Exact Mass316.13
IUPAC NameN-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide
SMILESCc1cccc(C)c1NCC(=O)NCCc1cccc(Cl)c1
InChIInChI=1S/C18H21ClN2O/c1-13-5-3-6-14(2)18(13)21-12-17(22)20-10-9-15-7-4-8-16(19)11-15/h3-8,11,21H,9-10,12H2,1-2H3,(H,20,22)
InChIKeyAMWUCEFFJGZPJC-UHFFFAOYSA-N
XLogP3.73
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.83
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-(3-chlorophenyl)ethyl]-2-(2,6-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-(3-chlorophenyl)ethyl]-2-(3,5-dimethylanilino)acetamide
CID 109006812
N-[2-(3-chlorophenyl)ethyl]-2-(3,5-dichloroanilino)acetamide
CID 109006882
N-[2-(3-chlorophenyl)ethyl]-2-[(2-methylphenyl)methylamino]acetamide
CID 108996547
2-(3-acetamidoanilino)-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 109006850
N-[2-(4-chlorophenyl)ethyl]-2-(2-ethyl-6-methylanilino)acetamide
CID 109002951
methyl N-[2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl]carbamate
CID 112995851
N,N'-bis[2-(3-chlorophenyl)ethyl]butanediamide
CID 2166305
2-(5-chloro-2-methylanilino)-N-(2-phenylethyl)acetamide
CID 26439038
N-[2-(3-chlorophenyl)ethyl]-2-[2-(4-chlorophenyl)ethylamino]acetamide
CID 109002830
2-(benzylamino)-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 108996409
N-[2-(3-chlorophenyl)ethyl]-2-(propan-2-ylcarbamoylamino)acetamide
CID 112995856
N-[2-(3-chlorophenyl)ethyl]-2-[4-(4-methylpiperazin-1-yl)anilino]acetamide
CID 109006861

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide?
The IUPAC name of N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide (CID 32908644) is N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide.
What is the SMILES notation for N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide?
The canonical SMILES for N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide is Cc1cccc(C)c1NCC(=O)NCCc1cccc(Cl)c1.
What is the InChIKey of N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide?
The InChIKey is AMWUCEFFJGZPJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN2O/c1-13-5-3-6-14(2)18(13)21-12-17(22)20-10-9-15-7-4-8-16(19)11-15/h3-8,11,21H,9-10,12H2,1-2H3,(H,20,22).
What are the key properties of N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide?
N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide has a molecular weight of 316.83 g/mol, XLogP of 3.73, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-chlorophenyl)ethyl]-2-(2,6-dimethylanilino)acetamide is sourced from PubChem (CID 32908644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).