2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide

C23H20FNO3 — CID 2564956

IUPAC2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide
SMILESCc1ccc(CNC(=O)COc2ccc(C(=O)c3ccc(F)cc3)cc2)cc1
InChIInChI=1S/C23H20FNO3/c1-16-2-4-17(5-3-16)14-25-22(26)15-28-21-12-8-19(9-13-21)23(27)18-6-10-20(24)11-7-18/h2-13H,14-15H2,1H3,(H,25,26)
InChIKeyFSYBDEFYUTUJNC-UHFFFAOYSA-N
MW377.42 g/mol
LogP4.06
Rot. Bonds7

About 2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide

2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide (PubChem CID 2564956) has the molecular formula C23H20FNO3 and a molecular weight of 377.42 g/mol. Its IUPAC name is 2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide
PubChem CID2564956
Molecular FormulaC23H20FNO3
Molecular Weight377.42 g/mol
Exact Mass377.14
IUPAC Name2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide
SMILESCc1ccc(CNC(=O)COc2ccc(C(=O)c3ccc(F)cc3)cc2)cc1
InChIInChI=1S/C23H20FNO3/c1-16-2-4-17(5-3-16)14-25-22(26)15-28-21-12-8-19(9-13-21)23(27)18-6-10-20(24)11-7-18/h2-13H,14-15H2,1H3,(H,25,26)
InChIKeyFSYBDEFYUTUJNC-UHFFFAOYSA-N
XLogP4.06
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.42
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 42262
4-(4-((Phenethylamino)methyl)phenoxy)benzamide
CID 44434950
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CID 2222870
N-(4-methoxybenzyl)[1,1'-biphenyl]-4-carboxamide
CID 710674
AdipoRon
CID 16307093
N-(3-(trifluoromethyl)benzyl)-4-phenoxybenzamide
CID 11703439
GT-0198
CID 71584823
4-methyl-N-[2-(4-methylphenoxy)ethyl]benzamide
CID 2222949
N-[2-(4-methoxyphenoxy)ethyl]-4-methylbenzamide
CID 2222974
2-fluoro-N-[2-(4-methylphenoxy)ethyl]benzamide
CID 2225978
4-tert-butyl-N-(2-phenoxyethyl)benzamide
CID 2244662
4-methoxy-N-(3-phenylpropyl)benzamide
CID 1744311

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide?
The IUPAC name of 2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide (CID 2564956) is 2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide is Cc1ccc(CNC(=O)COc2ccc(C(=O)c3ccc(F)cc3)cc2)cc1.
What is the InChIKey of 2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide?
The InChIKey is FSYBDEFYUTUJNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20FNO3/c1-16-2-4-17(5-3-16)14-25-22(26)15-28-21-12-8-19(9-13-21)23(27)18-6-10-20(24)11-7-18/h2-13H,14-15H2,1H3,(H,25,26).
What are the key properties of 2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide?
2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide has a molecular weight of 377.42 g/mol, XLogP of 4.06, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-fluorobenzoyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide is sourced from PubChem (CID 2564956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).