N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide

C23H22N2O4 — CID 2446225

IUPACN-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccc(NC(C)=O)cc2)ccc1OCc1ccccc1
InChIInChI=1S/C23H22N2O4/c1-16(26)24-19-9-11-20(12-10-19)25-23(27)18-8-13-21(22(14-18)28-2)29-15-17-6-4-3-5-7-17/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyYAPKWFMQZBYXKB-UHFFFAOYSA-N
MW390.44 g/mol
LogP4.48
Rot. Bonds7

About N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide

N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide (PubChem CID 2446225) has the molecular formula C23H22N2O4 and a molecular weight of 390.44 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide
PubChem CID2446225
Molecular FormulaC23H22N2O4
Molecular Weight390.44 g/mol
Exact Mass390.16
IUPAC NameN-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccc(NC(C)=O)cc2)ccc1OCc1ccccc1
InChIInChI=1S/C23H22N2O4/c1-16(26)24-19-9-11-20(12-10-19)25-23(27)18-8-13-21(22(14-18)28-2)29-15-17-6-4-3-5-7-17/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyYAPKWFMQZBYXKB-UHFFFAOYSA-N
XLogP4.48
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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VU0357121
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CID 584690
2,3-Dihydro-N-methyl-N-[2-oxo-2-[(2,3,4-trifluorophenyl)amino]ethyl]-1,4-benzodioxin-6-carboxamide
CID 8001903
N-(3-acetylphenyl)-3,4,5-trimethoxybenzamide
CID 692750
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-3-ethoxybenzamide
CID 739217
N-[4-(diethylamino)phenyl]-1,3-benzodioxole-5-carboxamide
CID 844944
N-[2-(tert-butylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide
CID 847830
(3E)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-1H-indol-2-one
CID 947879

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide?
The IUPAC name of N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide (CID 2446225) is N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide.
What is the SMILES notation for N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide?
The canonical SMILES for N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide is COc1cc(C(=O)Nc2ccc(NC(C)=O)cc2)ccc1OCc1ccccc1.
What is the InChIKey of N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide?
The InChIKey is YAPKWFMQZBYXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O4/c1-16(26)24-19-9-11-20(12-10-19)25-23(27)18-8-13-21(22(14-18)28-2)29-15-17-6-4-3-5-7-17/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide?
N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide has a molecular weight of 390.44 g/mol, XLogP of 4.48, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-3-methoxy-4-phenylmethoxybenzamide is sourced from PubChem (CID 2446225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).