3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide

C15H12Cl2N2O3 — CID 155519254

IUPAC3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide
SMILESO=C(NO)c1ccc(CNC(=O)c2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C15H12Cl2N2O3/c16-12-6-5-11(7-13(12)17)14(20)18-8-9-1-3-10(4-2-9)15(21)19-22/h1-7,22H,8H2,(H,18,20)(H,19,21)
InChIKeyARSRPMMXCDOZIA-UHFFFAOYSA-N
MW339.18 g/mol
LogP3.04
Rot. Bonds4

About 3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide

3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide (PubChem CID 155519254) has the molecular formula C15H12Cl2N2O3 and a molecular weight of 339.18 g/mol. Its IUPAC name is 3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide
PubChem CID155519254
Molecular FormulaC15H12Cl2N2O3
Molecular Weight339.18 g/mol
Exact Mass338.02
IUPAC Name3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide
SMILESO=C(NO)c1ccc(CNC(=O)c2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C15H12Cl2N2O3/c16-12-6-5-11(7-13(12)17)14(20)18-8-9-1-3-10(4-2-9)15(21)19-22/h1-7,22H,8H2,(H,18,20)(H,19,21)
InChIKeyARSRPMMXCDOZIA-UHFFFAOYSA-N
XLogP3.04
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.18
LogP ≤ 53.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide?
The IUPAC name of 3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide (CID 155519254) is 3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide.
What is the SMILES notation for 3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide?
The canonical SMILES for 3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide is O=C(NO)c1ccc(CNC(=O)c2ccc(Cl)c(Cl)c2)cc1.
What is the InChIKey of 3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide?
The InChIKey is ARSRPMMXCDOZIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O3/c16-12-6-5-11(7-13(12)17)14(20)18-8-9-1-3-10(4-2-9)15(21)19-22/h1-7,22H,8H2,(H,18,20)(H,19,21).
What are the key properties of 3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide?
3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide has a molecular weight of 339.18 g/mol, XLogP of 3.04, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dichloro-N-[[4-(hydroxycarbamoyl)phenyl]methyl]benzamide is sourced from PubChem (CID 155519254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).