N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide

C28H24N2O3 — CID 28638866

IUPACN-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)Nc1cccc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C28H24N2O3/c31-27(20-33-26-16-14-23(15-17-26)22-10-5-2-6-11-22)30-25-13-7-12-24(18-25)28(32)29-19-21-8-3-1-4-9-21/h1-18H,19-20H2,(H,29,32)(H,30,31)
InChIKeyAZBXCKDXXRAAHP-UHFFFAOYSA-N
MW436.51 g/mol
LogP5.30
Rot. Bonds8

About N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide

N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide (PubChem CID 28638866) has the molecular formula C28H24N2O3 and a molecular weight of 436.51 g/mol. Its IUPAC name is N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide
PubChem CID28638866
Molecular FormulaC28H24N2O3
Molecular Weight436.51 g/mol
Exact Mass436.18
IUPAC NameN-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)Nc1cccc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C28H24N2O3/c31-27(20-33-26-16-14-23(15-17-26)22-10-5-2-6-11-22)30-25-13-7-12-24(18-25)28(32)29-19-21-8-3-1-4-9-21/h1-18H,19-20H2,(H,29,32)(H,30,31)
InChIKeyAZBXCKDXXRAAHP-UHFFFAOYSA-N
XLogP5.30
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.51
LogP ≤ 55.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-4-[[2-(4-phenylphenoxy)acetyl]amino]benzamide
CID 28639925
N-benzyl-3-[(4-phenylbenzoyl)amino]benzamide
CID 28638755
N-benzyl-3-[2-(4-cyanoanilino)-2-oxoethoxy]benzamide
CID 9253189
N-benzyl-4-[[2-(4-methylphenoxy)acetyl]amino]benzamide
CID 28639871
N-benzyl-3-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide
CID 28638799
3-[[2-[4-(4-cyanophenyl)phenoxy]acetyl]amino]-N-ethylbenzamide
CID 9019837
N,N'-bis[3-(benzylcarbamoyl)phenyl]nonanediamide
CID 43887216
N-benzyl-3-[[2-(4-bromo-2-methylphenoxy)acetyl]amino]benzamide
CID 28638819
N-benzyl-3-[2-(3-chloro-4-fluoroanilino)-2-oxoethoxy]benzamide
CID 7492272
2-(4-phenylphenoxy)-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 26161597
N-[3-(azepane-1-carbonyl)phenyl]-2-(4-phenylphenoxy)acetamide
CID 26159412
methyl 4-[3-(benzylcarbamoyl)anilino]-4-oxobutanoate
CID 28638820

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide?
The IUPAC name of N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide (CID 28638866) is N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide.
What is the SMILES notation for N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide?
The canonical SMILES for N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide is O=C(COc1ccc(-c2ccccc2)cc1)Nc1cccc(C(=O)NCc2ccccc2)c1.
What is the InChIKey of N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide?
The InChIKey is AZBXCKDXXRAAHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N2O3/c31-27(20-33-26-16-14-23(15-17-26)22-10-5-2-6-11-22)30-25-13-7-12-24(18-25)28(32)29-19-21-8-3-1-4-9-21/h1-18H,19-20H2,(H,29,32)(H,30,31).
What are the key properties of N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide?
N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide has a molecular weight of 436.51 g/mol, XLogP of 5.30, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-[[2-(4-phenylphenoxy)acetyl]amino]benzamide is sourced from PubChem (CID 28638866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).