4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide

C22H19FN2O3 — CID 2677119

IUPAC4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(NC(=O)Cc3ccccc3F)cc2)cc1
InChIInChI=1S/C22H19FN2O3/c1-28-19-12-10-18(11-13-19)25-22(27)15-6-8-17(9-7-15)24-21(26)14-16-4-2-3-5-20(16)23/h2-13H,14H2,1H3,(H,24,26)(H,25,27)
InChIKeyBJHNAAJKTYKKKR-UHFFFAOYSA-N
MW378.40 g/mol
LogP4.27
Rot. Bonds6

About 4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide

4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide (PubChem CID 2677119) has the molecular formula C22H19FN2O3 and a molecular weight of 378.40 g/mol. Its IUPAC name is 4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide
PubChem CID2677119
Molecular FormulaC22H19FN2O3
Molecular Weight378.40 g/mol
Exact Mass378.14
IUPAC Name4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(NC(=O)Cc3ccccc3F)cc2)cc1
InChIInChI=1S/C22H19FN2O3/c1-28-19-12-10-18(11-13-19)25-22(27)15-6-8-17(9-7-15)24-21(26)14-16-4-2-3-5-20(16)23/h2-13H,14H2,1H3,(H,24,26)(H,25,27)
InChIKeyBJHNAAJKTYKKKR-UHFFFAOYSA-N
XLogP4.27
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.40
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(2-fluorophenyl)methylamino]phenyl]-4-methoxybenzamide
CID 112982380
2-fluoro-N-[4-[(4-methoxybenzoyl)amino]phenyl]benzamide
CID 1287432
N-[(2-fluorophenyl)methyl]-4-methoxybenzamide
CID 7758239
4-[3-(2,5-difluorophenyl)propanoylamino]-N-(4-methoxyphenyl)benzamide
CID 55996525
[3-[[4-[[2-(2-fluorophenyl)acetyl]amino]phenyl]carbamoyl]phenyl] acetate
CID 108927714
methyl 4-[[2-[[2-(2-fluorophenyl)acetyl]amino]acetyl]amino]benzoate
CID 112999954
N-[4-[(2-fluorophenyl)methylamino]phenyl]-3,5-dimethoxybenzamide
CID 112982381
N-[4-(2,4-dimethoxyanilino)phenyl]-2-(2-fluorophenyl)acetamide
CID 112987949
4-(3-benzamidopropanoylamino)-N-(4-methoxyphenyl)benzamide
CID 8884300
N-(4-methoxyphenyl)-4-(3-oxobutanoylamino)benzamide
CID 110178700
N-(4-methoxyphenyl)-2-(2-methylphenyl)acetamide
CID 6467093
2-(2-fluorophenyl)-N-(4-propoxyphenyl)acetamide
CID 110493409

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide?
The IUPAC name of 4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide (CID 2677119) is 4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide.
What is the SMILES notation for 4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide?
The canonical SMILES for 4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide is COc1ccc(NC(=O)c2ccc(NC(=O)Cc3ccccc3F)cc2)cc1.
What is the InChIKey of 4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide?
The InChIKey is BJHNAAJKTYKKKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN2O3/c1-28-19-12-10-18(11-13-19)25-22(27)15-6-8-17(9-7-15)24-21(26)14-16-4-2-3-5-20(16)23/h2-13H,14H2,1H3,(H,24,26)(H,25,27).
What are the key properties of 4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide?
4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide has a molecular weight of 378.40 g/mol, XLogP of 4.27, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide is sourced from PubChem (CID 2677119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).