N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride

C11H15Cl3N2O — CID 119670901

IUPACN-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
SMILESCNCC(C)C(=O)Nc1ccc(Cl)c(Cl)c1.Cl
InChIInChI=1S/C11H14Cl2N2O.ClH/c1-7(6-14-2)11(16)15-8-3-4-9(12)10(13)5-8;/h3-5,7,14H,6H2,1-2H3,(H,15,16);1H
InChIKeyIZXNPGOXNNMTLA-UHFFFAOYSA-N
MW297.61 g/mol
LogP3.21
Rot. Bonds4

About N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride

N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride (PubChem CID 119670901) has the molecular formula C11H15Cl3N2O and a molecular weight of 297.61 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
PubChem CID119670901
Molecular FormulaC11H15Cl3N2O
Molecular Weight297.61 g/mol
Exact Mass296.02
IUPAC NameN-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
SMILESCNCC(C)C(=O)Nc1ccc(Cl)c(Cl)c1.Cl
InChIInChI=1S/C11H14Cl2N2O.ClH/c1-7(6-14-2)11(16)15-8-3-4-9(12)10(13)5-8;/h3-5,7,14H,6H2,1-2H3,(H,15,16);1H
InChIKeyIZXNPGOXNNMTLA-UHFFFAOYSA-N
XLogP3.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.61
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride 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

2-chloro-5-[[2-methyl-3-(methylamino)propanoyl]amino]benzoic acid
CID 79195612
2-chloro-N-methyl-5-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide
CID 79196615
N-(4-chloro-3-cyanophenyl)-2-methyl-3-(methylamino)propanamide
CID 79196264
N-(4-chloro-3-nitrophenyl)-2-methyl-3-(methylamino)propanamide
CID 79195599
N-[3-chloro-4-(2-methylpropoxy)phenyl]-2-methyl-3-(methylamino)propanamide
CID 119715596
N-[3-chloro-4-(1-phenylethylamino)phenyl]-2-methyl-3-(methylamino)propanamide
CID 119743334
N-(6-chloro-3-pyridinyl)-2-methyl-3-(methylamino)propanamide
CID 81489773
(2S)-2-amino-N-(3,4-dichlorophenyl)propanamide
CID 22690595
N-[4-chloro-3-(diethylsulfamoyl)phenyl]-2-methyl-3-(methylamino)propanamide
CID 119679906
N-[4-(carbamoylamino)phenyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119701452
N-(4-iodophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119672677
N-[3-(carbamoylamino)phenyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119702019

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
The IUPAC name of N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride (CID 119670901) is N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
The canonical SMILES for N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride is CNCC(C)C(=O)Nc1ccc(Cl)c(Cl)c1.Cl.
What is the InChIKey of N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
The InChIKey is IZXNPGOXNNMTLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Cl2N2O.ClH/c1-7(6-14-2)11(16)15-8-3-4-9(12)10(13)5-8;/h3-5,7,14H,6H2,1-2H3,(H,15,16);1H.
What are the key properties of N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride has a molecular weight of 297.61 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride is sourced from PubChem (CID 119670901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).