3,5-diacetyl-N-hydroxy-N-phenylbenzamide

C17H15NO4 — CID 87586597

IUPAC3,5-diacetyl-N-hydroxy-N-phenylbenzamide
SMILESCC(=O)c1cc(C(C)=O)cc(C(=O)N(O)c2ccccc2)c1
InChIInChI=1S/C17H15NO4/c1-11(19)13-8-14(12(2)20)10-15(9-13)17(21)18(22)16-6-4-3-5-7-16/h3-10,22H,1-2H3
InChIKeyKWSVXBAYYTXVIK-UHFFFAOYSA-N
MW297.31 g/mol
LogP3.13
Rot. Bonds4

About 3,5-diacetyl-N-hydroxy-N-phenylbenzamide

3,5-diacetyl-N-hydroxy-N-phenylbenzamide (PubChem CID 87586597) has the molecular formula C17H15NO4 and a molecular weight of 297.31 g/mol. Its IUPAC name is 3,5-diacetyl-N-hydroxy-N-phenylbenzamide.

Molecular Properties

Compound Name3,5-diacetyl-N-hydroxy-N-phenylbenzamide
PubChem CID87586597
Molecular FormulaC17H15NO4
Molecular Weight297.31 g/mol
Exact Mass297.10
IUPAC Name3,5-diacetyl-N-hydroxy-N-phenylbenzamide
SMILESCC(=O)c1cc(C(C)=O)cc(C(=O)N(O)c2ccccc2)c1
InChIInChI=1S/C17H15NO4/c1-11(19)13-8-14(12(2)20)10-15(9-13)17(21)18(22)16-6-4-3-5-7-16/h3-10,22H,1-2H3
InChIKeyKWSVXBAYYTXVIK-UHFFFAOYSA-N
XLogP3.13
TPSA74.68 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-N-phenylbenzamide;tungsten
CID 159148219
5-acetyl-1-N,3-N-dimethyl-1-N,3-N-diphenylbenzene-1,3-dicarboxamide;ethane;toluene
CID 143365757
4-(dimethylamino)-N-hydroxy-N-phenylbenzamide
CID 71402496
4-bromo-N-hydroxy-N-phenylbenzamide
CID 25115715
3-chloro-N-hydroxy-N-phenylbenzamide
CID 73332862
1-azulen-2-ylethanone
CID 15255141
N-(4-chlorophenyl)-N-hydroxybenzamide
CID 15217
1-(cyclotetradecaheptaenyl)ethanone
CID 90871438
4-butyl-N-hydroxy-N-phenylbenzamide
CID 14768049
(2S)-N-hydroxy-2-[(2S)-1-(N-hydroxyanilino)-1-oxopropan-2-yl]sulfinyl-N-phenylpropanamide
CID 87844242
2-chloro-N-hydroxy-N-phenylpropanamide
CID 57100198
lithium 1-phenylethanone
CID 22269591

Frequently Asked Questions

What is the IUPAC name of 3,5-diacetyl-N-hydroxy-N-phenylbenzamide?
The IUPAC name of 3,5-diacetyl-N-hydroxy-N-phenylbenzamide (CID 87586597) is 3,5-diacetyl-N-hydroxy-N-phenylbenzamide.
What is the SMILES notation for 3,5-diacetyl-N-hydroxy-N-phenylbenzamide?
The canonical SMILES for 3,5-diacetyl-N-hydroxy-N-phenylbenzamide is CC(=O)c1cc(C(C)=O)cc(C(=O)N(O)c2ccccc2)c1.
What is the InChIKey of 3,5-diacetyl-N-hydroxy-N-phenylbenzamide?
The InChIKey is KWSVXBAYYTXVIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO4/c1-11(19)13-8-14(12(2)20)10-15(9-13)17(21)18(22)16-6-4-3-5-7-16/h3-10,22H,1-2H3.
What are the key properties of 3,5-diacetyl-N-hydroxy-N-phenylbenzamide?
3,5-diacetyl-N-hydroxy-N-phenylbenzamide has a molecular weight of 297.31 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diacetyl-N-hydroxy-N-phenylbenzamide is sourced from PubChem (CID 87586597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).