N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide

C15H14Cl2N2O — CID 16772418

IUPACN-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2c(Cl)cc(N)cc2Cl)c(C)c1
InChIInChI=1S/C15H14Cl2N2O/c1-8-3-4-11(9(2)5-8)15(20)19-14-12(16)6-10(18)7-13(14)17/h3-7H,18H2,1-2H3,(H,19,20)
InChIKeyHFHCWHDHJMATNC-UHFFFAOYSA-N
MW309.20 g/mol
LogP4.44
Rot. Bonds2

About N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide

N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide (PubChem CID 16772418) has the molecular formula C15H14Cl2N2O and a molecular weight of 309.20 g/mol. Its IUPAC name is N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide.

Molecular Properties

Compound NameN-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide
PubChem CID16772418
Molecular FormulaC15H14Cl2N2O
Molecular Weight309.20 g/mol
Exact Mass308.05
IUPAC NameN-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2c(Cl)cc(N)cc2Cl)c(C)c1
InChIInChI=1S/C15H14Cl2N2O/c1-8-3-4-11(9(2)5-8)15(20)19-14-12(16)6-10(18)7-13(14)17/h3-7H,18H2,1-2H3,(H,19,20)
InChIKeyHFHCWHDHJMATNC-UHFFFAOYSA-N
XLogP4.44
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.20
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide 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-chloro-4-methylphenyl)-2,4-dimethylbenzamide
CID 2557643
2-amino-5-methyl-N-(2,4,6-trichlorophenyl)benzamide
CID 62510533
N-(2-amino-6-methylphenyl)-2,4-dimethylbenzamide
CID 43330062
N-(2-chloro-4-iodophenyl)-2,4-dimethylbenzamide
CID 1287536
N-(3,5-dichloro-4-hydroxyphenyl)-2,4-dimethylbenzamide
CID 82884847
N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide
CID 925377
4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide
CID 20565335
2-amino-N-(2,6-dichloro-4-fluorophenyl)-5-methylbenzamide
CID 83076619
4-amino-2-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 28967456
N-(4-amino-2-chloro-6-methylphenyl)-2-methoxybenzamide
CID 100817238
N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide
CID 64788271
5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide
CID 107624082

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide?
The IUPAC name of N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide (CID 16772418) is N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide.
What is the SMILES notation for N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide?
The canonical SMILES for N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide is Cc1ccc(C(=O)Nc2c(Cl)cc(N)cc2Cl)c(C)c1.
What is the InChIKey of N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide?
The InChIKey is HFHCWHDHJMATNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O/c1-8-3-4-11(9(2)5-8)15(20)19-14-12(16)6-10(18)7-13(14)17/h3-7H,18H2,1-2H3,(H,19,20).
What are the key properties of N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide?
N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide has a molecular weight of 309.20 g/mol, XLogP of 4.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide is sourced from PubChem (CID 16772418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).