N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide

C22H19ClN2O3 — CID 25255713

IUPACN-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide
SMILESO=C(NO)c1cccc(-c2cccc(C(=O)NCCc3cccc(Cl)c3)c2)c1
InChIInChI=1S/C22H19ClN2O3/c23-20-9-1-4-15(12-20)10-11-24-21(26)18-7-2-5-16(13-18)17-6-3-8-19(14-17)22(27)25-28/h1-9,12-14,28H,10-11H2,(H,24,26)(H,25,27)
InChIKeySWBXFKMEVOWPKM-UHFFFAOYSA-N
MW394.86 g/mol
LogP4.10
Rot. Bonds6

About N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide

N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide (PubChem CID 25255713) has the molecular formula C22H19ClN2O3 and a molecular weight of 394.86 g/mol. Its IUPAC name is N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide.

Molecular Properties

Compound NameN-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide
PubChem CID25255713
Molecular FormulaC22H19ClN2O3
Molecular Weight394.86 g/mol
Exact Mass394.11
IUPAC NameN-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide
SMILESO=C(NO)c1cccc(-c2cccc(C(=O)NCCc3cccc(Cl)c3)c2)c1
InChIInChI=1S/C22H19ClN2O3/c23-20-9-1-4-15(12-20)10-11-24-21(26)18-7-2-5-16(13-18)17-6-3-8-19(14-17)22(27)25-28/h1-9,12-14,28H,10-11H2,(H,24,26)(H,25,27)
InChIKeySWBXFKMEVOWPKM-UHFFFAOYSA-N
XLogP4.10
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.86
LogP ≤ 54.10
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 N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]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-N-[2-(3-chlorophenyl)ethyl]benzamide
CID 28722348
N-[2-(3-chlorophenyl)ethyl]-3-ethylbenzamide;ethane
CID 143158267
3,4-dichloro-N-[2-(3-chlorophenyl)ethyl]benzamide
CID 888038
3-N-[2-(3-chlorophenyl)ethyl]-1-N-pentylbenzene-1,3-dicarboxamide
CID 109056265
N-[2-(3-chlorophenyl)ethyl]-3-cyanobenzamide
CID 31251030
N-[2-(3-chlorophenyl)ethyl]-4-hydroxy-3-phenylbenzamide
CID 154832803
3-[4-(hydroxycarbamoyl)phenyl]-N-[2-[3-(trifluoromethyl)phenyl]ethyl]benzamide
CID 91058519
N-[2-(3-chlorophenyl)ethyl]-3-(methylsulfonylmethyl)benzamide
CID 27838781
N-[2-[[N-[2-(3-chlorophenyl)ethyl]-N'-methylcarbamimidoyl]amino]ethyl]benzamide;hydroiodide
CID 111358335
N-[2-(3-chlorophenyl)ethyl]-4-fluoro-3-methylbenzamide
CID 63213299
N-[2-(3-chlorophenyl)ethyl]-3-(methanesulfonamido)benzamide
CID 18114724
3-(2,6-dichlorophenyl)-N-(2-phenylethyl)benzamide
CID 86048215

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide?
The IUPAC name of N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide (CID 25255713) is N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide.
What is the SMILES notation for N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide?
The canonical SMILES for N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide is O=C(NO)c1cccc(-c2cccc(C(=O)NCCc3cccc(Cl)c3)c2)c1.
What is the InChIKey of N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide?
The InChIKey is SWBXFKMEVOWPKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19ClN2O3/c23-20-9-1-4-15(12-20)10-11-24-21(26)18-7-2-5-16(13-18)17-6-3-8-19(14-17)22(27)25-28/h1-9,12-14,28H,10-11H2,(H,24,26)(H,25,27).
What are the key properties of N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide?
N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide has a molecular weight of 394.86 g/mol, XLogP of 4.10, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide is sourced from PubChem (CID 25255713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).