3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide

C10H12Cl2N2O — CID 28795222

IUPAC3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide
SMILESCN(C(=O)CCN)c1ccc(Cl)cc1Cl
InChIInChI=1S/C10H12Cl2N2O/c1-14(10(15)4-5-13)9-3-2-7(11)6-8(9)12/h2-3,6H,4-5,13H2,1H3
InChIKeyORTKMMOTRIAGQK-UHFFFAOYSA-N
MW247.12 g/mol
LogP2.31
Rot. Bonds3

About 3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide

3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide (PubChem CID 28795222) has the molecular formula C10H12Cl2N2O and a molecular weight of 247.12 g/mol. Its IUPAC name is 3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide.

Molecular Properties

Compound Name3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide
PubChem CID28795222
Molecular FormulaC10H12Cl2N2O
Molecular Weight247.12 g/mol
Exact Mass246.03
IUPAC Name3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide
SMILESCN(C(=O)CCN)c1ccc(Cl)cc1Cl
InChIInChI=1S/C10H12Cl2N2O/c1-14(10(15)4-5-13)9-3-2-7(11)6-8(9)12/h2-3,6H,4-5,13H2,1H3
InChIKeyORTKMMOTRIAGQK-UHFFFAOYSA-N
XLogP2.31
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.12
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide 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

3-cyano-N-(2,4-dichlorophenyl)-N-methylpropanamide
CID 115173703
4-amino-N-(5-chloro-2-fluorophenyl)-N-methylbutanamide
CID 115155218
2-amino-N-(2,4-dichlorophenyl)-N-ethylacetamide
CID 28794920
3-amino-N-methyl-N-(2-methylphenyl)propanamide
CID 28794972
3-amino-N-(5-chloro-2-methoxy-3-methylphenyl)-N-methylpropanamide
CID 82499843
N-(2-chlorophenyl)-N-methylbutanamide
CID 12936039
3-amino-N-[(4-chlorophenyl)methyl]-N-methylpropanamide
CID 39246978
2-amino-N-(2-benzyl-4-chlorophenyl)-N-methylacetamide
CID 145157722
3-amino-1-[3-chloro-4-(dimethylamino)phenyl]propan-1-one
CID 117325981
N-(2-amino-5-chlorophenyl)-N,4-dimethylpentanamide
CID 107465588
4-amino-N-(5-chloro-2-fluorophenyl)-N-methylpentanamide
CID 115156651
3-amino-N-(2-methoxyphenyl)-N-methylpropanamide
CID 28795107

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide?
The IUPAC name of 3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide (CID 28795222) is 3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide.
What is the SMILES notation for 3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide?
The canonical SMILES for 3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide is CN(C(=O)CCN)c1ccc(Cl)cc1Cl.
What is the InChIKey of 3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide?
The InChIKey is ORTKMMOTRIAGQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2N2O/c1-14(10(15)4-5-13)9-3-2-7(11)6-8(9)12/h2-3,6H,4-5,13H2,1H3.
What are the key properties of 3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide?
3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide has a molecular weight of 247.12 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide is sourced from PubChem (CID 28795222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).