N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide

C25H25NO3 — CID 142273250

IUPACN-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide
SMILESO=C(CCCCCc1cccc(-c2ccc(C(=O)NO)cc2)c1)c1ccccc1
InChIInChI=1S/C25H25NO3/c27-24(21-10-4-2-5-11-21)13-6-1-3-8-19-9-7-12-23(18-19)20-14-16-22(17-15-20)25(28)26-29/h2,4-5,7,9-12,14-18,29H,1,3,6,8,13H2,(H,26,28)
InChIKeyJYIXGBVGGLRFMB-UHFFFAOYSA-N
MW387.48 g/mol
LogP5.46
Rot. Bonds9

About N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide

N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide (PubChem CID 142273250) has the molecular formula C25H25NO3 and a molecular weight of 387.48 g/mol. Its IUPAC name is N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide
PubChem CID142273250
Molecular FormulaC25H25NO3
Molecular Weight387.48 g/mol
Exact Mass387.18
IUPAC NameN-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide
SMILESO=C(CCCCCc1cccc(-c2ccc(C(=O)NO)cc2)c1)c1ccccc1
InChIInChI=1S/C25H25NO3/c27-24(21-10-4-2-5-11-21)13-6-1-3-8-19-9-7-12-23(18-19)20-14-16-22(17-15-20)25(28)26-29/h2,4-5,7,9-12,14-18,29H,1,3,6,8,13H2,(H,26,28)
InChIKeyJYIXGBVGGLRFMB-UHFFFAOYSA-N
XLogP5.46
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.48
LogP ≤ 55.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-methyl-N-[[3-[4-(6-phenylhexanoyl)phenyl]phenyl]methyl]acetamide
CID 161031506
2-[2-[4-[3-(4-carboxybutyl)phenyl]phenyl]-2-oxoethyl]-5-phenylpentanoic acid
CID 151610990
3-(3-hydroxyphenyl)-1-(4-phenylphenyl)propan-1-one
CID 58190197
4-[5-(4-benzamidophenyl)pentanoyl]-N-[4-(4-oxo-4-phenylbutyl)phenyl]benzamide
CID 123843128
1,15-diphenylpentadecane-1,15-dione
CID 159981687
5-(3-phenylphenyl)pentan-1-ol
CID 57054310
ethane;6-hydroxy-1-(4-phenylphenyl)hexan-1-one
CID 142964448
N-hydroxy-3-[(4-phenylbenzoyl)amino]benzamide
CID 142750431
N-phenyl-4-(4-phenylbutanoyl)benzamide
CID 123756436
ethyl 5-(3-phenylphenyl)pentanoate
CID 146915917
3-[4-(hydroxycarbamoyl)phenyl]-N-[2-[3-(trifluoromethyl)phenyl]ethyl]benzamide
CID 91058519
6-(3-methoxyphenyl)-1-(4-methoxyphenyl)hexan-1-one
CID 164679633

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide?
The IUPAC name of N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide (CID 142273250) is N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide.
What is the SMILES notation for N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide?
The canonical SMILES for N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide is O=C(CCCCCc1cccc(-c2ccc(C(=O)NO)cc2)c1)c1ccccc1.
What is the InChIKey of N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide?
The InChIKey is JYIXGBVGGLRFMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25NO3/c27-24(21-10-4-2-5-11-21)13-6-1-3-8-19-9-7-12-23(18-19)20-14-16-22(17-15-20)25(28)26-29/h2,4-5,7,9-12,14-18,29H,1,3,6,8,13H2,(H,26,28).
What are the key properties of N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide?
N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide has a molecular weight of 387.48 g/mol, XLogP of 5.46, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[3-(6-oxo-6-phenylhexyl)phenyl]benzamide is sourced from PubChem (CID 142273250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).