3-amino-4-(2,4-dichlorophenoxy)benzamide

C13H10Cl2N2O2 — CID 43448525

IUPAC3-amino-4-(2,4-dichlorophenoxy)benzamide
SMILESNC(=O)c1ccc(Oc2ccc(Cl)cc2Cl)c(N)c1
InChIInChI=1S/C13H10Cl2N2O2/c14-8-2-4-11(9(15)6-8)19-12-3-1-7(13(17)18)5-10(12)16/h1-6H,16H2,(H2,17,18)
InChIKeyFGPXEBUQBRCAQE-UHFFFAOYSA-N
MW297.14 g/mol
LogP3.47
Rot. Bonds3

About 3-amino-4-(2,4-dichlorophenoxy)benzamide

3-amino-4-(2,4-dichlorophenoxy)benzamide (PubChem CID 43448525) has the molecular formula C13H10Cl2N2O2 and a molecular weight of 297.14 g/mol. Its IUPAC name is 3-amino-4-(2,4-dichlorophenoxy)benzamide.

Molecular Properties

Compound Name3-amino-4-(2,4-dichlorophenoxy)benzamide
PubChem CID43448525
Molecular FormulaC13H10Cl2N2O2
Molecular Weight297.14 g/mol
Exact Mass296.01
IUPAC Name3-amino-4-(2,4-dichlorophenoxy)benzamide
SMILESNC(=O)c1ccc(Oc2ccc(Cl)cc2Cl)c(N)c1
InChIInChI=1S/C13H10Cl2N2O2/c14-8-2-4-11(9(15)6-8)19-12-3-1-7(13(17)18)5-10(12)16/h1-6H,16H2,(H2,17,18)
InChIKeyFGPXEBUQBRCAQE-UHFFFAOYSA-N
XLogP3.47
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.14
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-amino-4-(2,4-dichlorophenoxy)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

3-amino-4-(4-bromo-2-chlorophenoxy)benzamide
CID 43448570
3-amino-4-(4-chloro-2-methylphenoxy)benzamide
CID 43448530
3-amino-4-(2-chlorophenoxy)benzamide
CID 43382705
3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide
CID 86084993
4-amino-3-(4-chloro-2-methylphenoxy)benzamide
CID 55188748
1-[3-chloro-4-(2,4-dichlorophenoxy)phenyl]ethanone
CID 63532509
2-amino-5-(2,4-dichlorophenoxy)terephthalic acid
CID 771613
3-[3-amino-4-(2,4-dichlorophenoxy)phenyl]propanoic acid
CID 70276085
3-amino-4-(2,4-dibromophenoxy)benzamide
CID 64720185
1-[3-amino-4-(2-bromo-4-chlorophenoxy)phenyl]ethanone
CID 170632658
2-(2,4-dichlorophenoxy)-5-methylsulfonylaniline
CID 43448156
methyl 3-amino-4-(2-chloro-4-methylphenoxy)benzoate
CID 62674146

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-(2,4-dichlorophenoxy)benzamide?
The IUPAC name of 3-amino-4-(2,4-dichlorophenoxy)benzamide (CID 43448525) is 3-amino-4-(2,4-dichlorophenoxy)benzamide.
What is the SMILES notation for 3-amino-4-(2,4-dichlorophenoxy)benzamide?
The canonical SMILES for 3-amino-4-(2,4-dichlorophenoxy)benzamide is NC(=O)c1ccc(Oc2ccc(Cl)cc2Cl)c(N)c1.
What is the InChIKey of 3-amino-4-(2,4-dichlorophenoxy)benzamide?
The InChIKey is FGPXEBUQBRCAQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N2O2/c14-8-2-4-11(9(15)6-8)19-12-3-1-7(13(17)18)5-10(12)16/h1-6H,16H2,(H2,17,18).
What are the key properties of 3-amino-4-(2,4-dichlorophenoxy)benzamide?
3-amino-4-(2,4-dichlorophenoxy)benzamide has a molecular weight of 297.14 g/mol, XLogP of 3.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-(2,4-dichlorophenoxy)benzamide is sourced from PubChem (CID 43448525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).