3-[(4-phenylmethoxybenzoyl)amino]benzamide

C21H18N2O3 — CID 78779054

IUPAC3-[(4-phenylmethoxybenzoyl)amino]benzamide
SMILESNC(=O)c1cccc(NC(=O)c2ccc(OCc3ccccc3)cc2)c1
InChIInChI=1S/C21H18N2O3/c22-20(24)17-7-4-8-18(13-17)23-21(25)16-9-11-19(12-10-16)26-14-15-5-2-1-3-6-15/h1-13H,14H2,(H2,22,24)(H,23,25)
InChIKeyZQOVNPDXPDBMNF-UHFFFAOYSA-N
MW346.39 g/mol
LogP3.62
Rot. Bonds6

About 3-[(4-phenylmethoxybenzoyl)amino]benzamide

3-[(4-phenylmethoxybenzoyl)amino]benzamide (PubChem CID 78779054) has the molecular formula C21H18N2O3 and a molecular weight of 346.39 g/mol. Its IUPAC name is 3-[(4-phenylmethoxybenzoyl)amino]benzamide.

Molecular Properties

Compound Name3-[(4-phenylmethoxybenzoyl)amino]benzamide
PubChem CID78779054
Molecular FormulaC21H18N2O3
Molecular Weight346.39 g/mol
Exact Mass346.13
IUPAC Name3-[(4-phenylmethoxybenzoyl)amino]benzamide
SMILESNC(=O)c1cccc(NC(=O)c2ccc(OCc3ccccc3)cc2)c1
InChIInChI=1S/C21H18N2O3/c22-20(24)17-7-4-8-18(13-17)23-21(25)16-9-11-19(12-10-16)26-14-15-5-2-1-3-6-15/h1-13H,14H2,(H2,22,24)(H,23,25)
InChIKeyZQOVNPDXPDBMNF-UHFFFAOYSA-N
XLogP3.62
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 ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-phenoxyethoxy)-N-(3-phenylmethoxyphenyl)benzamide
CID 17086099
N-[(3-benzamidophenyl)carbamothioyl]-4-phenylmethoxybenzamide
CID 17113536
3-[[4-[(4-fluorophenyl)methoxy]benzoyl]amino]benzoic acid
CID 139501079
4-phenylmethoxy-N-(3-prop-2-enoxyphenyl)benzamide
CID 17086755
N-(3-phenylmethoxyphenyl)-4-propoxybenzamide
CID 17086082
N-[3-[acetyl(methyl)amino]phenyl]-4-phenylmethoxybenzamide
CID 46761920
3-(4-phenylmethoxyphenyl)benzamide
CID 152538567
N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide
CID 110006010
N-[4-(phenoxymethyl)phenyl]benzamide
CID 141092226
N-[3-(phenoxymethyl)phenyl]-4-(trifluoromethyl)benzamide
CID 91610384
4-[(4-chlorophenyl)methoxy]-N-[3-(2-hydroxyacetyl)phenyl]benzamide
CID 23354553
3-[[4-(2-phenylethynyl)benzoyl]amino]benzamide
CID 22110606

Frequently Asked Questions

What is the IUPAC name of 3-[(4-phenylmethoxybenzoyl)amino]benzamide?
The IUPAC name of 3-[(4-phenylmethoxybenzoyl)amino]benzamide (CID 78779054) is 3-[(4-phenylmethoxybenzoyl)amino]benzamide.
What is the SMILES notation for 3-[(4-phenylmethoxybenzoyl)amino]benzamide?
The canonical SMILES for 3-[(4-phenylmethoxybenzoyl)amino]benzamide is NC(=O)c1cccc(NC(=O)c2ccc(OCc3ccccc3)cc2)c1.
What is the InChIKey of 3-[(4-phenylmethoxybenzoyl)amino]benzamide?
The InChIKey is ZQOVNPDXPDBMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O3/c22-20(24)17-7-4-8-18(13-17)23-21(25)16-9-11-19(12-10-16)26-14-15-5-2-1-3-6-15/h1-13H,14H2,(H2,22,24)(H,23,25).
What are the key properties of 3-[(4-phenylmethoxybenzoyl)amino]benzamide?
3-[(4-phenylmethoxybenzoyl)amino]benzamide has a molecular weight of 346.39 g/mol, XLogP of 3.62, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-phenylmethoxybenzoyl)amino]benzamide is sourced from PubChem (CID 78779054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).