2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide

C23H23NO3 — CID 135320561

IUPAC2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide
SMILESCc1cc(C)cc(COc2cccc(C(C(=O)NO)c3ccccc3)c2)c1
InChIInChI=1S/C23H23NO3/c1-16-11-17(2)13-18(12-16)15-27-21-10-6-9-20(14-21)22(23(25)24-26)19-7-4-3-5-8-19/h3-14,22,26H,15H2,1-2H3,(H,24,25)
InChIKeyBWPLJWMSMLWOOF-UHFFFAOYSA-N
MW361.44 g/mol
LogP4.52
Rot. Bonds6

About 2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide

2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide (PubChem CID 135320561) has the molecular formula C23H23NO3 and a molecular weight of 361.44 g/mol. Its IUPAC name is 2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide.

Molecular Properties

Compound Name2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide
PubChem CID135320561
Molecular FormulaC23H23NO3
Molecular Weight361.44 g/mol
Exact Mass361.17
IUPAC Name2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide
SMILESCc1cc(C)cc(COc2cccc(C(C(=O)NO)c3ccccc3)c2)c1
InChIInChI=1S/C23H23NO3/c1-16-11-17(2)13-18(12-16)15-27-21-10-6-9-20(14-21)22(23(25)24-26)19-7-4-3-5-8-19/h3-14,22,26H,15H2,1-2H3,(H,24,25)
InChIKeyBWPLJWMSMLWOOF-UHFFFAOYSA-N
XLogP4.52
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.44
LogP ≤ 54.52
H-Bond Donors ≤ 52
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

2-[3-[3-(dimethylamino)propoxy]phenyl]-N-hydroxy-2-phenylacetamide
CID 25155089
2-[3-[2-(4-fluorophenoxy)ethoxy]phenyl]-N-hydroxy-2-phenylacetamide
CID 135320414
1,3-dimethyl-5-(phenoxymethyl)benzene
CID 20649368
1,3-dimethyl-5-[(3-methylphenoxy)methyl]benzene
CID 60644540
3,5-bis(3-phenylmethoxyphenyl)heptan-4-one
CID 139719265
3-[(3,5-dimethylphenyl)methoxy]aniline
CID 54909105
N-hydroxy-2-[4-[4-(methoxymethyl)phenyl]phenyl]-2-phenylacetamide
CID 135320572
[(1S)-2-ethoxy-2-oxo-1-(3-phenylmethoxyphenyl)ethyl]azanium
CID 7046932
N-[3-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]benzamide
CID 135320195
N-[(3-methylphenyl)methyl]-2,2-diphenylacetamide
CID 38293786
N'-(2,2-diphenylacetyl)-2-(3-methylphenoxy)propanehydrazide
CID 4931348
methyl 2-[3-[(2,2-diphenylacetyl)amino]phenoxy]acetate
CID 1301261

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide?
The IUPAC name of 2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide (CID 135320561) is 2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide.
What is the SMILES notation for 2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide?
The canonical SMILES for 2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide is Cc1cc(C)cc(COc2cccc(C(C(=O)NO)c3ccccc3)c2)c1.
What is the InChIKey of 2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide?
The InChIKey is BWPLJWMSMLWOOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO3/c1-16-11-17(2)13-18(12-16)15-27-21-10-6-9-20(14-21)22(23(25)24-26)19-7-4-3-5-8-19/h3-14,22,26H,15H2,1-2H3,(H,24,25).
What are the key properties of 2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide?
2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide has a molecular weight of 361.44 g/mol, XLogP of 4.52, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-N-hydroxy-2-phenylacetamide is sourced from PubChem (CID 135320561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).