N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide

C23H22N2O4 — CID 55901703

IUPACN-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1
InChIInChI=1S/C23H22N2O4/c1-16-11-12-21(28-2)20(13-16)23(27)25-18-9-6-10-19(14-18)29-15-22(26)24-17-7-4-3-5-8-17/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyGAMWGAHALYJJSI-UHFFFAOYSA-N
MW390.44 g/mol
LogP4.27
Rot. Bonds7

About N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide

N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide (PubChem CID 55901703) has the molecular formula C23H22N2O4 and a molecular weight of 390.44 g/mol. Its IUPAC name is N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide.

Molecular Properties

Compound NameN-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide
PubChem CID55901703
Molecular FormulaC23H22N2O4
Molecular Weight390.44 g/mol
Exact Mass390.16
IUPAC NameN-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1
InChIInChI=1S/C23H22N2O4/c1-16-11-12-21(28-2)20(13-16)23(27)25-18-9-6-10-19(14-18)29-15-22(26)24-17-7-4-3-5-8-17/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyGAMWGAHALYJJSI-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-methoxy-N-[4-[2-(3-methoxyanilino)-2-oxoethoxy]phenyl]benzamide
CID 18224632
2,5-dimethoxy-N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]benzamide
CID 55886827
2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide
CID 2709122
5-chloro-N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-methoxybenzamide
CID 39045106
2-[2-(3-methoxyanilino)-2-oxoethoxy]-4-methylbenzoic acid
CID 45418378
2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide
CID 2787094
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
2-methoxy-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
CID 38397232
2-(2-bromo-4-methylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 1008619
N-[3-(2-anilino-2-oxoethoxy)phenyl]-1-(4-methylphenyl)-5-propan-2-ylpyrazole-4-carboxamide
CID 55901328
2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 17123518
N-(2-methoxy-5-methylphenyl)-2-(3-phenoxyphenoxy)acetamide
CID 2108595

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide?
The IUPAC name of N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide (CID 55901703) is N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide.
What is the SMILES notation for N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide?
The canonical SMILES for N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide is COc1ccc(C)cc1C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1.
What is the InChIKey of N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide?
The InChIKey is GAMWGAHALYJJSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O4/c1-16-11-12-21(28-2)20(13-16)23(27)25-18-9-6-10-19(14-18)29-15-22(26)24-17-7-4-3-5-8-17/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide?
N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-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-[3-(2-anilino-2-oxoethoxy)phenyl]-2-methoxy-5-methylbenzamide is sourced from PubChem (CID 55901703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).