N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide

C15H15NO3 — CID 10038175

IUPACN-[dideuterio-(4-methoxyphenyl)methoxy]benzamide
SMILES[2H]C([2H])(ONC(=O)c1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C15H15NO3/c1-18-14-9-7-12(8-10-14)11-19-16-15(17)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,16,17)/i11D2
InChIKeyLZXUADSTZNHATJ-ZWGOZCLVSA-N
MW259.30 g/mol
LogP2.56
Rot. Bonds5

About N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide

N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide (PubChem CID 10038175) has the molecular formula C15H15NO3 and a molecular weight of 259.30 g/mol. Its IUPAC name is N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide.

Molecular Properties

Compound NameN-[dideuterio-(4-methoxyphenyl)methoxy]benzamide
PubChem CID10038175
Molecular FormulaC15H15NO3
Molecular Weight259.30 g/mol
Exact Mass259.12
IUPAC NameN-[dideuterio-(4-methoxyphenyl)methoxy]benzamide
SMILES[2H]C([2H])(ONC(=O)c1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C15H15NO3/c1-18-14-9-7-12(8-10-14)11-19-16-15(17)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,16,17)/i11D2
InChIKeyLZXUADSTZNHATJ-ZWGOZCLVSA-N
XLogP2.56
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.30
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[dideuterio-(4-nitrophenyl)methoxy]benzamide
CID 10061879
4-methoxy-N-(2-phenoxyethoxy)benzamide
CID 110294662
N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide
CID 2270387
N-[(4-methylphenyl)methoxy]benzamide
CID 2366824
[2-(2-benzoylhydrazinyl)-2-oxoethyl] 3-(4-methoxyphenyl)propanoate
CID 2523165
[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-benzamidoacetate
CID 2625536
N-[2-[acetyl-[2-(4-methoxyphenyl)ethyl]amino]ethyl]benzamide
CID 113055959
(4-methoxyphenyl) 2-benzamidoacetate
CID 23275662
N-[2-(4-methoxyphenyl)ethylcarbamothioyl]benzamide
CID 4266550
(4-methoxyphenyl) 1-[4-(phenylmethoxycarbamoyl)phenyl]cyclohexane-1-carboxylate
CID 87731590
N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113041752
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936

Frequently Asked Questions

What is the IUPAC name of N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide?
The IUPAC name of N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide (CID 10038175) is N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide.
What is the SMILES notation for N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide?
The canonical SMILES for N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide is [2H]C([2H])(ONC(=O)c1ccccc1)c1ccc(OC)cc1.
What is the InChIKey of N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide?
The InChIKey is LZXUADSTZNHATJ-ZWGOZCLVSA-N. The full InChI is InChI=1S/C15H15NO3/c1-18-14-9-7-12(8-10-14)11-19-16-15(17)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,16,17)/i11D2.
What are the key properties of N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide?
N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide has a molecular weight of 259.30 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide is sourced from PubChem (CID 10038175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).