N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide

C25H20N2O2 — CID 171408668

IUPACN-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide
SMILESO=C(NO)c1ccc(Nc2ccc(-c3ccccc3)cc2)cc1-c1ccccc1
InChIInChI=1S/C25H20N2O2/c28-25(27-29)23-16-15-22(17-24(23)20-9-5-2-6-10-20)26-21-13-11-19(12-14-21)18-7-3-1-4-8-18/h1-17,26,29H,(H,27,28)
InChIKeyPTTLUEGHWBFPHF-UHFFFAOYSA-N
MW380.45 g/mol
LogP5.88
Rot. Bonds5

About N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide

N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide (PubChem CID 171408668) has the molecular formula C25H20N2O2 and a molecular weight of 380.45 g/mol. Its IUPAC name is N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide.

Molecular Properties

Compound NameN-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide
PubChem CID171408668
Molecular FormulaC25H20N2O2
Molecular Weight380.45 g/mol
Exact Mass380.15
IUPAC NameN-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide
SMILESO=C(NO)c1ccc(Nc2ccc(-c3ccccc3)cc2)cc1-c1ccccc1
InChIInChI=1S/C25H20N2O2/c28-25(27-29)23-16-15-22(17-24(23)20-9-5-2-6-10-20)26-21-13-11-19(12-14-21)18-7-3-1-4-8-18/h1-17,26,29H,(H,27,28)
InChIKeyPTTLUEGHWBFPHF-UHFFFAOYSA-N
XLogP5.88
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.45
LogP ≤ 55.88
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'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide?
The IUPAC name of N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide (CID 171408668) is N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide.
What is the SMILES notation for N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide?
The canonical SMILES for N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide is O=C(NO)c1ccc(Nc2ccc(-c3ccccc3)cc2)cc1-c1ccccc1.
What is the InChIKey of N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide?
The InChIKey is PTTLUEGHWBFPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2O2/c28-25(27-29)23-16-15-22(17-24(23)20-9-5-2-6-10-20)26-21-13-11-19(12-14-21)18-7-3-1-4-8-18/h1-17,26,29H,(H,27,28).
What are the key properties of N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide?
N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide has a molecular weight of 380.45 g/mol, XLogP of 5.88, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-phenyl-4-(4-phenylanilino)benzamide is sourced from PubChem (CID 171408668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).