N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide

C23H22N2O4 — CID 17252265

IUPACN-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc(NC(=O)c2cccc(C)c2)cc1
InChIInChI=1S/C23H22N2O4/c1-16-6-5-7-17(14-16)23(27)25-19-12-10-18(11-13-19)24-22(26)15-29-21-9-4-3-8-20(21)28-2/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyUSNAEZSHMZWAFV-UHFFFAOYSA-N
MW390.44 g/mol
LogP4.27
Rot. Bonds7

About N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide

N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide (PubChem CID 17252265) has the molecular formula C23H22N2O4 and a molecular weight of 390.44 g/mol. Its IUPAC name is N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide.

Molecular Properties

Compound NameN-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide
PubChem CID17252265
Molecular FormulaC23H22N2O4
Molecular Weight390.44 g/mol
Exact Mass390.16
IUPAC NameN-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc(NC(=O)c2cccc(C)c2)cc1
InChIInChI=1S/C23H22N2O4/c1-16-6-5-7-17(14-16)23(27)25-19-12-10-18(11-13-19)24-22(26)15-29-21-9-4-3-8-20(21)28-2/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyUSNAEZSHMZWAFV-UHFFFAOYSA-N
XLogP4.27
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 ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
N-[4-[[2-(2,4-dimethylphenoxy)acetyl]amino]phenyl]-3,4-dimethoxybenzamide
CID 108935771
3-[[2-(2-methylphenoxy)acetyl]amino]-N-(3-methylphenyl)benzamide
CID 26164549
N-(2-benzamidoethyl)-4-[[2-(2-methoxyphenoxy)acetyl]amino]benzamide
CID 121063227
N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-nitrobenzamide
CID 55865426
N-tert-butyl-3-[[2-(2-methoxyphenoxy)acetyl]amino]benzamide
CID 9323551
N-[4-[[2-(3-methoxyanilino)acetyl]amino]phenyl]-3-methylbenzamide
CID 54814544
3-[[2-(2,5-dimethylphenoxy)acetyl]amino]-N-(3-methylphenyl)benzamide
CID 26164583
N-(3,4-dimethylphenyl)-4-[2-(4-fluoroanilino)-2-oxoethoxy]-3-methoxybenzamide
CID 8744099
3-methyl-N-[4-[(2-phenylacetyl)amino]phenyl]benzamide
CID 5343922
2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide
CID 2709122
2-(2-methoxyphenoxy)-N-[6-(3-methylanilino)pyridazin-3-yl]acetamide
CID 113045737

Frequently Asked Questions

What is the IUPAC name of N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide?
The IUPAC name of N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide (CID 17252265) is N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide.
What is the SMILES notation for N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide?
The canonical SMILES for N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide is COc1ccccc1OCC(=O)Nc1ccc(NC(=O)c2cccc(C)c2)cc1.
What is the InChIKey of N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide?
The InChIKey is USNAEZSHMZWAFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O4/c1-16-6-5-7-17(14-16)23(27)25-19-12-10-18(11-13-19)24-22(26)15-29-21-9-4-3-8-20(21)28-2/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide?
N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide has a molecular weight of 390.44 g/mol, XLogP of 4.27, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide is sourced from PubChem (CID 17252265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).