2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide

C23H21NO3 — CID 55843893

IUPAC2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide
SMILESCCOc1cccc(CNC(=O)c2ccccc2C(=O)c2ccccc2)c1
InChIInChI=1S/C23H21NO3/c1-2-27-19-12-8-9-17(15-19)16-24-23(26)21-14-7-6-13-20(21)22(25)18-10-4-3-5-11-18/h3-15H,2,16H2,1H3,(H,24,26)
InChIKeyYYIGDINUHMDQAU-UHFFFAOYSA-N
MW359.43 g/mol
LogP4.25
Rot. Bonds7

About 2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide

2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide (PubChem CID 55843893) has the molecular formula C23H21NO3 and a molecular weight of 359.43 g/mol. Its IUPAC name is 2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide
PubChem CID55843893
Molecular FormulaC23H21NO3
Molecular Weight359.43 g/mol
Exact Mass359.15
IUPAC Name2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide
SMILESCCOc1cccc(CNC(=O)c2ccccc2C(=O)c2ccccc2)c1
InChIInChI=1S/C23H21NO3/c1-2-27-19-12-8-9-17(15-19)16-24-23(26)21-14-7-6-13-20(21)22(25)18-10-4-3-5-11-18/h3-15H,2,16H2,1H3,(H,24,26)
InChIKeyYYIGDINUHMDQAU-UHFFFAOYSA-N
XLogP4.25
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-[(3-ethoxybenzoyl)amino]benzamide
CID 4957453
N-[(3-ethoxyphenyl)methyl]-3-methylbenzamide
CID 28572765
3-amino-N-[(3-ethoxyphenyl)methyl]-2-methylbenzamide
CID 78984271
N-[(3-ethoxyphenyl)methyl]-3,5-dimethoxybenzamide
CID 92683249
N-[(3-ethoxyphenyl)methylcarbamoyl]-2-hydroxybenzamide
CID 142955511
2-benzoyl-N-[[3-(butanoylamino)phenyl]methyl]benzamide
CID 60515223
N-benzyl-2-[(3-ethoxybenzoyl)carbamothioylamino]benzamide
CID 4957707
4-chloro-N-[(3-ethoxyphenyl)methyl]-2-fluorobenzamide
CID 56920573
2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide
CID 55801218
6-[(3-ethoxyphenyl)methylcarbamoyl]pyridine-2-carboxylic acid
CID 75513273
N-[(3-ethoxyphenyl)methyl]-2,3-difluoropyridine-4-carboxamide
CID 105380764
2-[(3-ethoxyphenyl)methylamino]benzoic acid
CID 60874267

Frequently Asked Questions

What is the IUPAC name of 2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide?
The IUPAC name of 2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide (CID 55843893) is 2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide.
What is the SMILES notation for 2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide?
The canonical SMILES for 2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide is CCOc1cccc(CNC(=O)c2ccccc2C(=O)c2ccccc2)c1.
What is the InChIKey of 2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide?
The InChIKey is YYIGDINUHMDQAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO3/c1-2-27-19-12-8-9-17(15-19)16-24-23(26)21-14-7-6-13-20(21)22(25)18-10-4-3-5-11-18/h3-15H,2,16H2,1H3,(H,24,26).
What are the key properties of 2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide?
2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide has a molecular weight of 359.43 g/mol, XLogP of 4.25, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide is sourced from PubChem (CID 55843893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).