3-[[(3-phenoxybenzoyl)amino]methyl]benzamide

C21H18N2O3 — CID 32636499

IUPAC3-[[(3-phenoxybenzoyl)amino]methyl]benzamide
SMILESNC(=O)c1cccc(CNC(=O)c2cccc(Oc3ccccc3)c2)c1
InChIInChI=1S/C21H18N2O3/c22-20(24)16-7-4-6-15(12-16)14-23-21(25)17-8-5-11-19(13-17)26-18-9-2-1-3-10-18/h1-13H,14H2,(H2,22,24)(H,23,25)
InChIKeyHDNBHMMAPZIFFU-UHFFFAOYSA-N
MW346.39 g/mol
LogP3.51
Rot. Bonds6

About 3-[[(3-phenoxybenzoyl)amino]methyl]benzamide

3-[[(3-phenoxybenzoyl)amino]methyl]benzamide (PubChem CID 32636499) has the molecular formula C21H18N2O3 and a molecular weight of 346.39 g/mol. Its IUPAC name is 3-[[(3-phenoxybenzoyl)amino]methyl]benzamide.

Molecular Properties

Compound Name3-[[(3-phenoxybenzoyl)amino]methyl]benzamide
PubChem CID32636499
Molecular FormulaC21H18N2O3
Molecular Weight346.39 g/mol
Exact Mass346.13
IUPAC Name3-[[(3-phenoxybenzoyl)amino]methyl]benzamide
SMILESNC(=O)c1cccc(CNC(=O)c2cccc(Oc3ccccc3)c2)c1
InChIInChI=1S/C21H18N2O3/c22-20(24)16-7-4-6-15(12-16)14-23-21(25)17-8-5-11-19(13-17)26-18-9-2-1-3-10-18/h1-13H,14H2,(H2,22,24)(H,23,25)
InChIKeyHDNBHMMAPZIFFU-UHFFFAOYSA-N
XLogP3.51
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-carbamoylphenyl)methyl]-5-phenoxyfuran-2-carboxamide
CID 71863392
3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide
CID 33097042
benzyl 2-[(3-phenoxybenzoyl)amino]acetate
CID 7980431
N-[[3-[2-(4-phenoxyphenoxy)ethoxy]phenyl]methyl]benzamide
CID 173183648
3-[(carbamoylamino)methyl]benzamide
CID 166184789
3-[[[3-(dimethylamino)benzoyl]amino]methyl]benzamide
CID 32636517
N-[(3-carbamoylphenyl)methyl]-9-oxofluorene-2-carboxamide
CID 32637447
4-acetamido-N-[(3-phenoxyphenyl)methyl]benzamide
CID 39022053
3-(aminomethyl)-6-[3-[(3-phenoxyphenyl)methylcarbamoyl]phenyl]pyrazine-2-carboxamide
CID 91338091
2-(hydroxymethyl)-N-[(3-phenoxyphenyl)methyl]pyridine-4-carboxamide
CID 166384916
3-(ethylsulfamoyl)-N-[(3-phenoxyphenyl)methyl]benzamide
CID 39576293
N-benzyl-4-[4-(benzylcarbamoyl)phenoxy]benzamide
CID 2223099

Frequently Asked Questions

What is the IUPAC name of 3-[[(3-phenoxybenzoyl)amino]methyl]benzamide?
The IUPAC name of 3-[[(3-phenoxybenzoyl)amino]methyl]benzamide (CID 32636499) is 3-[[(3-phenoxybenzoyl)amino]methyl]benzamide.
What is the SMILES notation for 3-[[(3-phenoxybenzoyl)amino]methyl]benzamide?
The canonical SMILES for 3-[[(3-phenoxybenzoyl)amino]methyl]benzamide is NC(=O)c1cccc(CNC(=O)c2cccc(Oc3ccccc3)c2)c1.
What is the InChIKey of 3-[[(3-phenoxybenzoyl)amino]methyl]benzamide?
The InChIKey is HDNBHMMAPZIFFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O3/c22-20(24)16-7-4-6-15(12-16)14-23-21(25)17-8-5-11-19(13-17)26-18-9-2-1-3-10-18/h1-13H,14H2,(H2,22,24)(H,23,25).
What are the key properties of 3-[[(3-phenoxybenzoyl)amino]methyl]benzamide?
3-[[(3-phenoxybenzoyl)amino]methyl]benzamide has a molecular weight of 346.39 g/mol, XLogP of 3.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3-phenoxybenzoyl)amino]methyl]benzamide is sourced from PubChem (CID 32636499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).