N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide

C23H20FNO3 — CID 132656695

IUPACN-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide
SMILESCCC(Oc1ccc(F)cc1)C(=O)Nc1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C23H20FNO3/c1-2-21(28-18-14-12-17(24)13-15-18)23(27)25-20-11-7-6-10-19(20)22(26)16-8-4-3-5-9-16/h3-15,21H,2H2,1H3,(H,25,27)
InChIKeyCEZXEPPEEVIWTB-UHFFFAOYSA-N
MW377.42 g/mol
LogP4.85
Rot. Bonds7

About N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide

N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide (PubChem CID 132656695) has the molecular formula C23H20FNO3 and a molecular weight of 377.42 g/mol. Its IUPAC name is N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide.

Molecular Properties

Compound NameN-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide
PubChem CID132656695
Molecular FormulaC23H20FNO3
Molecular Weight377.42 g/mol
Exact Mass377.14
IUPAC NameN-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide
SMILESCCC(Oc1ccc(F)cc1)C(=O)Nc1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C23H20FNO3/c1-2-21(28-18-14-12-17(24)13-15-18)23(27)25-20-11-7-6-10-19(20)22(26)16-8-4-3-5-9-16/h3-15,21H,2H2,1H3,(H,25,27)
InChIKeyCEZXEPPEEVIWTB-UHFFFAOYSA-N
XLogP4.85
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 ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(4-fluorophenoxy)butanoylamino]benzamide
CID 43906030
N-butyl-2-[[(2S)-2-(4-fluorophenoxy)butanoyl]amino]benzamide
CID 28632385
N-(2-chlorophenyl)-2-(4-fluorophenoxy)butanamide
CID 46771035
N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide
CID 43886444
2-[[(2S)-2-phenoxybutanoyl]amino]benzamide
CID 898266
(2S)-N-(2-fluorophenyl)-2-phenoxybutanamide
CID 966418
(2R)-N-(2-benzoyl-4-chlorophenyl)-2-(3,4-dimethylphenoxy)butanamide
CID 92681200
2-[2-(4-fluorophenoxy)butanoylamino]-N-(oxolan-2-ylmethyl)benzamide
CID 133255501
N-(4-ethoxyphenyl)-2-(2-phenoxybutanoylamino)benzamide
CID 4929653
methyl 2-[2-(4-ethylphenoxy)butanoylamino]benzoate
CID 132652180
(2S)-N-(2-benzoyl-4-chlorophenyl)-2-(3-methoxyphenoxy)butanamide
CID 99952036
2-[[(2S)-2-(4-ethylphenoxy)butanoyl]amino]benzamide
CID 99133167

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide?
The IUPAC name of N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide (CID 132656695) is N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide.
What is the SMILES notation for N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide?
The canonical SMILES for N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide is CCC(Oc1ccc(F)cc1)C(=O)Nc1ccccc1C(=O)c1ccccc1.
What is the InChIKey of N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide?
The InChIKey is CEZXEPPEEVIWTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20FNO3/c1-2-21(28-18-14-12-17(24)13-15-18)23(27)25-20-11-7-6-10-19(20)22(26)16-8-4-3-5-9-16/h3-15,21H,2H2,1H3,(H,25,27).
What are the key properties of N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide?
N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide has a molecular weight of 377.42 g/mol, XLogP of 4.85, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide is sourced from PubChem (CID 132656695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).