N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide

C21H18N2O3 — CID 135320195

IUPACN-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide
SMILESO=C(Nc1cccc(C(C(=O)NO)c2ccccc2)c1)c1ccccc1
InChIInChI=1S/C21H18N2O3/c24-20(16-10-5-2-6-11-16)22-18-13-7-12-17(14-18)19(21(25)23-26)15-8-3-1-4-9-15/h1-14,19,26H,(H,22,24)(H,23,25)
InChIKeyUUBNTDULJDIMSZ-UHFFFAOYSA-N
MW346.39 g/mol
LogP3.58
Rot. Bonds5

About N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide

N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide (PubChem CID 135320195) has the molecular formula C21H18N2O3 and a molecular weight of 346.39 g/mol. Its IUPAC name is N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide.

Molecular Properties

Compound NameN-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide
PubChem CID135320195
Molecular FormulaC21H18N2O3
Molecular Weight346.39 g/mol
Exact Mass346.13
IUPAC NameN-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide
SMILESO=C(Nc1cccc(C(C(=O)NO)c2ccccc2)c1)c1ccccc1
InChIInChI=1S/C21H18N2O3/c24-20(16-10-5-2-6-11-16)22-18-13-7-12-17(14-18)19(21(25)23-26)15-8-3-1-4-9-15/h1-14,19,26H,(H,22,24)(H,23,25)
InChIKeyUUBNTDULJDIMSZ-UHFFFAOYSA-N
XLogP3.58
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 53.58
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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Related Compounds

N-hydroxy-2-phenyl-2-[3-[(2-phenylsulfanylacetyl)amino]phenyl]acetamide
CID 135320520
N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]-3-methylthiophene-2-carboxamide
CID 135320550
N-hydroxy-2-phenyl-2-[3-[(2-thiophen-2-ylacetyl)amino]phenyl]acetamide
CID 135320497
3-benzamido-N-(3-bromophenyl)benzamide
CID 1304486
3-[(2,2-diphenylacetyl)amino]-N-(1-phenylethyl)benzamide
CID 43877741
2,2-diphenyl-N-[3-(phenylcarbamoylamino)phenyl]acetamide
CID 18293083
N-hydroxy-3-[(4-phenylbenzoyl)amino]benzamide
CID 142750431
N-[3-(1-hydroxyethyl)phenyl]-4-phenylbenzamide
CID 18552677
N-[4-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]-4-(trifluoromethoxy)benzamide
CID 87444403
N-cyclopropyl-3-[(2,2-diphenylacetyl)amino]benzamide
CID 16567529
3-[(2,2-diphenylacetyl)carbamothioylamino]-N-methylbenzamide
CID 17233208
N-[3-[[(2R)-2-hydroxy-2-phenylacetyl]amino]phenyl]pyridine-4-carboxamide
CID 122132708

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide?
The IUPAC name of N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide (CID 135320195) is N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide.
What is the SMILES notation for N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide?
The canonical SMILES for N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide is O=C(Nc1cccc(C(C(=O)NO)c2ccccc2)c1)c1ccccc1.
What is the InChIKey of N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide?
The InChIKey is UUBNTDULJDIMSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O3/c24-20(16-10-5-2-6-11-16)22-18-13-7-12-17(14-18)19(21(25)23-26)15-8-3-1-4-9-15/h1-14,19,26H,(H,22,24)(H,23,25).
What are the key properties of N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide?
N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide has a molecular weight of 346.39 g/mol, XLogP of 3.58, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide is sourced from PubChem (CID 135320195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).