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

C13H11Cl2N3O — CID 20565335

IUPAC4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide
SMILESNc1ccc(C(=O)Nc2c(Cl)cc(N)cc2Cl)cc1
InChIInChI=1S/C13H11Cl2N3O/c14-10-5-9(17)6-11(15)12(10)18-13(19)7-1-3-8(16)4-2-7/h1-6H,16-17H2,(H,18,19)
InChIKeyYQSTVNJAQLPOGY-UHFFFAOYSA-N
MW296.16 g/mol
LogP3.41
Rot. Bonds2

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

4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide (PubChem CID 20565335) has the molecular formula C13H11Cl2N3O and a molecular weight of 296.16 g/mol. Its IUPAC name is 4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide.

Molecular Properties

Compound Name4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide
PubChem CID20565335
Molecular FormulaC13H11Cl2N3O
Molecular Weight296.16 g/mol
Exact Mass295.03
IUPAC Name4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide
SMILESNc1ccc(C(=O)Nc2c(Cl)cc(N)cc2Cl)cc1
InChIInChI=1S/C13H11Cl2N3O/c14-10-5-9(17)6-11(15)12(10)18-13(19)7-1-3-8(16)4-2-7/h1-6H,16-17H2,(H,18,19)
InChIKeyYQSTVNJAQLPOGY-UHFFFAOYSA-N
XLogP3.41
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.16
LogP ≤ 53.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide 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-amino-2,6-dichlorophenyl)-4-methoxybenzamide
CID 16774813
4-amino-N-(4-amino-2-chlorophenyl)benzamide
CID 577458
N-(4-amino-2,6-dichlorophenyl)naphthalene-2-carboxamide
CID 16775537
4-amino-N-(4-amino-2,6-dimethylphenyl)benzamide
CID 50880717
N-(4-amino-2,6-dichlorophenyl)-3-fluorobenzamide
CID 16776319
N-(4-amino-2-chloro-6-methoxyphenyl)-4-iodobenzamide
CID 100828565
N-(4-amino-2,6-dichlorophenyl)-2,4-dimethylbenzamide
CID 16772418
4-amino-N-(2,3,5,6-tetrafluorophenyl)benzamide
CID 107641222
3-amino-4-fluoro-N-(2,4,6-trichlorophenyl)benzamide
CID 43436994
4-(aminomethyl)-N-(4-bromo-2,6-dichlorophenyl)benzamide
CID 28993465
3-amino-N-(2,6-dichloro-4-fluorophenyl)-4-fluorobenzamide
CID 83076280
N-(4-bromo-2,6-dichlorophenyl)-4-fluorobenzamide
CID 60651944

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide?
The IUPAC name of 4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide (CID 20565335) is 4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide.
What is the SMILES notation for 4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide?
The canonical SMILES for 4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide is Nc1ccc(C(=O)Nc2c(Cl)cc(N)cc2Cl)cc1.
What is the InChIKey of 4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide?
The InChIKey is YQSTVNJAQLPOGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2N3O/c14-10-5-9(17)6-11(15)12(10)18-13(19)7-1-3-8(16)4-2-7/h1-6H,16-17H2,(H,18,19).
What are the key properties of 4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide?
4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide has a molecular weight of 296.16 g/mol, XLogP of 3.41, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-amino-2,6-dichlorophenyl)benzamide is sourced from PubChem (CID 20565335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).