3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide

C18H19Cl2NO — CID 100607664

IUPAC3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide
SMILESCc1ccc(CN(C)C(=O)CCc2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C18H19Cl2NO/c1-13-3-5-14(6-4-13)12-21(2)18(22)10-8-15-7-9-16(19)11-17(15)20/h3-7,9,11H,8,10,12H2,1-2H3
InChIKeyXQCXTFWAASONQK-UHFFFAOYSA-N
MW336.26 g/mol
LogP4.89
Rot. Bonds5

About 3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide

3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide (PubChem CID 100607664) has the molecular formula C18H19Cl2NO and a molecular weight of 336.26 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide
PubChem CID100607664
Molecular FormulaC18H19Cl2NO
Molecular Weight336.26 g/mol
Exact Mass335.08
IUPAC Name3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide
SMILESCc1ccc(CN(C)C(=O)CCc2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C18H19Cl2NO/c1-13-3-5-14(6-4-13)12-21(2)18(22)10-8-15-7-9-16(19)11-17(15)20/h3-7,9,11H,8,10,12H2,1-2H3
InChIKeyXQCXTFWAASONQK-UHFFFAOYSA-N
XLogP4.89
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.26
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide 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-[(4-cyanophenyl)methyl]-3-(2,4-dichlorophenyl)-N-methylpropanamide
CID 39862065
3-(4-chlorophenyl)-N-[(4-chlorophenyl)methyl]-N-methylpropanamide
CID 100590851
N-[(5-chloro-2-methoxyphenyl)methyl]-N-methyl-4-(4-methylphenyl)butanamide
CID 55772389
N-[(4-chlorophenyl)methyl]-2-(2,4-dimethylphenyl)-N-methylacetamide
CID 100559271
2-chloro-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 2450177
2-(2,5-dichlorophenoxy)-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 112774399
3-amino-N-[(4-chlorophenyl)methyl]-N-methylpropanamide
CID 39246978
3-cyano-N-[(2,4-dichlorophenyl)methyl]-N-methylpropanamide
CID 94697067
2-(4-aminophenyl)-N-[(2,4-dichlorophenyl)methyl]-N-methylacetamide
CID 60939480
1-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]methanesulfonamide
CID 38011114
3-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]-N-methylpropanamide
CID 31988959
3-[[4-[[2-(2,4-dichlorophenyl)ethyl-[(4-methylphenyl)methyl]amino]methyl]benzoyl]amino]propanoic acid
CID 18679913

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide?
The IUPAC name of 3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide (CID 100607664) is 3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide?
The canonical SMILES for 3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide is Cc1ccc(CN(C)C(=O)CCc2ccc(Cl)cc2Cl)cc1.
What is the InChIKey of 3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide?
The InChIKey is XQCXTFWAASONQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2NO/c1-13-3-5-14(6-4-13)12-21(2)18(22)10-8-15-7-9-16(19)11-17(15)20/h3-7,9,11H,8,10,12H2,1-2H3.
What are the key properties of 3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide?
3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide has a molecular weight of 336.26 g/mol, XLogP of 4.89, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenyl)-N-methyl-N-[(4-methylphenyl)methyl]propanamide is sourced from PubChem (CID 100607664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).