N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide

C18H20N2O4 — CID 53257584

IUPACN-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide
SMILESCOCCC(C(=O)Nc1ccc(C(=O)NO)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O4/c1-24-12-11-16(13-5-3-2-4-6-13)18(22)19-15-9-7-14(8-10-15)17(21)20-23/h2-10,16,23H,11-12H2,1H3,(H,19,22)(H,20,21)
InChIKeyKCTZFQMPYLBMIJ-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.56
Rot. Bonds7

About N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide

N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide (PubChem CID 53257584) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide
PubChem CID53257584
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC NameN-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide
SMILESCOCCC(C(=O)Nc1ccc(C(=O)NO)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O4/c1-24-12-11-16(13-5-3-2-4-6-13)18(22)19-15-9-7-14(8-10-15)17(21)20-23/h2-10,16,23H,11-12H2,1H3,(H,19,22)(H,20,21)
InChIKeyKCTZFQMPYLBMIJ-UHFFFAOYSA-N
XLogP2.56
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.56
H-Bond Donors ≤ 53
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-(2-methoxyphenyl)-4-[[(2S)-2-phenylpentanoyl]amino]benzamide
CID 9245233
N-hydroxy-4-[2-(4-methylphenyl)butanoylamino]benzamide
CID 123214374
N-hydroxy-4-[[(2S)-2-phenyl-2-(2-propylpentanoylamino)acetyl]amino]benzamide
CID 72705315
N-(2-benzamidoethyl)-4-(2-phenylbutanoylamino)benzamide
CID 121063165
4-[(2-amino-4-methoxybutanoyl)amino]-N-methylbenzamide
CID 55080716
N-(4-acetylphenyl)-3-amino-2-phenylpropanamide
CID 62877329
ethane;(2R)-N,2,5-triphenylpentanamide;(2S)-N,2,5-triphenylpentanamide
CID 160944914
N-(4-ethoxyphenyl)-2-phenylpentanamide
CID 112760775
4-[(3-amino-2-phenylpropanoyl)amino]-N-tert-butylbenzamide;hydrochloride
CID 119703080
N-(4-hydroxyphenyl)-2-phenylbutanamide
CID 17708
(2R)-N-(4-methylphenyl)-2-phenylbutanamide
CID 835806
2-phenyl-N-[4-(trifluoromethoxy)phenyl]pentanamide
CID 4845915

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide?
The IUPAC name of N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide (CID 53257584) is N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide.
What is the SMILES notation for N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide?
The canonical SMILES for N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide is COCCC(C(=O)Nc1ccc(C(=O)NO)cc1)c1ccccc1.
What is the InChIKey of N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide?
The InChIKey is KCTZFQMPYLBMIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-24-12-11-16(13-5-3-2-4-6-13)18(22)19-15-9-7-14(8-10-15)17(21)20-23/h2-10,16,23H,11-12H2,1H3,(H,19,22)(H,20,21).
What are the key properties of N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide?
N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide has a molecular weight of 328.37 g/mol, XLogP of 2.56, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[(4-methoxy-2-phenylbutanoyl)amino]benzamide is sourced from PubChem (CID 53257584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).