4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide

C23H22N2O5 — CID 46323186

IUPAC4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cc(NC(=O)COc3ccccc3)ccc2OC)cc1
InChIInChI=1S/C23H22N2O5/c1-28-18-11-8-16(9-12-18)23(27)25-20-14-17(10-13-21(20)29-2)24-22(26)15-30-19-6-4-3-5-7-19/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyXQNJYFZWGNAVBU-UHFFFAOYSA-N
MW406.44 g/mol
LogP3.97
Rot. Bonds8

About 4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide

4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide (PubChem CID 46323186) has the molecular formula C23H22N2O5 and a molecular weight of 406.44 g/mol. Its IUPAC name is 4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide
PubChem CID46323186
Molecular FormulaC23H22N2O5
Molecular Weight406.44 g/mol
Exact Mass406.15
IUPAC Name4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cc(NC(=O)COc3ccccc3)ccc2OC)cc1
InChIInChI=1S/C23H22N2O5/c1-28-18-11-8-16(9-12-18)23(27)25-20-14-17(10-13-21(20)29-2)24-22(26)15-30-19-6-4-3-5-7-19/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyXQNJYFZWGNAVBU-UHFFFAOYSA-N
XLogP3.97
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.44
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide?
The IUPAC name of 4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide (CID 46323186) is 4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide is COc1ccc(C(=O)Nc2cc(NC(=O)COc3ccccc3)ccc2OC)cc1.
What is the InChIKey of 4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide?
The InChIKey is XQNJYFZWGNAVBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O5/c1-28-18-11-8-16(9-12-18)23(27)25-20-14-17(10-13-21(20)29-2)24-22(26)15-30-19-6-4-3-5-7-19/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of 4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide?
4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide has a molecular weight of 406.44 g/mol, XLogP of 3.97, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide is sourced from PubChem (CID 46323186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).