2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide

C20H16FNO2 — CID 759350

IUPAC2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide
SMILESCc1ccc(Oc2ccc(NC(=O)c3ccccc3F)cc2)cc1
InChIInChI=1S/C20H16FNO2/c1-14-6-10-16(11-7-14)24-17-12-8-15(9-13-17)22-20(23)18-4-2-3-5-19(18)21/h2-13H,1H3,(H,22,23)
InChIKeyJZXOQTVSWYGRFR-UHFFFAOYSA-N
MW321.35 g/mol
LogP5.18
Rot. Bonds4

About 2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide

2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide (PubChem CID 759350) has the molecular formula C20H16FNO2 and a molecular weight of 321.35 g/mol. Its IUPAC name is 2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide
PubChem CID759350
Molecular FormulaC20H16FNO2
Molecular Weight321.35 g/mol
Exact Mass321.12
IUPAC Name2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide
SMILESCc1ccc(Oc2ccc(NC(=O)c3ccccc3F)cc2)cc1
InChIInChI=1S/C20H16FNO2/c1-14-6-10-16(11-7-14)24-17-12-8-15(9-13-17)22-20(23)18-4-2-3-5-19(18)21/h2-13H,1H3,(H,22,23)
InChIKeyJZXOQTVSWYGRFR-UHFFFAOYSA-N
XLogP5.18
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.35
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-N-[4-[(4-methylbenzoyl)amino]phenyl]benzamide
CID 577368
2-fluoro-N-[4-(4-nitrophenoxy)phenyl]benzamide
CID 23733524
2-fluoro-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 17340482
2-fluoro-N-[4-[(4-methoxybenzoyl)amino]phenyl]benzamide
CID 1287432
2-fluoro-N-[2-oxo-2-(4-phenoxyanilino)ethyl]benzamide
CID 9413646
2-fluoro-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 3424482
N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide
CID 16651045
[4-[(2-fluorobenzoyl)amino]phenyl] N-tert-butylcarbamate
CID 174384480
2-fluoro-N-[4-[3-(4-methoxyphenyl)-2-oxopropyl]phenyl]benzamide
CID 58422785
2-fluoro-N-[4-[[5-fluoro-2-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide
CID 90393813
3-methyl-N-[4-(4-methylphenoxy)phenyl]-2-nitrobenzamide
CID 7925169
2-fluoro-N-[2-[2-(4-methylphenoxy)anilino]-2-oxoethyl]benzamide
CID 17421842

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide?
The IUPAC name of 2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide (CID 759350) is 2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide?
The canonical SMILES for 2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide is Cc1ccc(Oc2ccc(NC(=O)c3ccccc3F)cc2)cc1.
What is the InChIKey of 2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide?
The InChIKey is JZXOQTVSWYGRFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FNO2/c1-14-6-10-16(11-7-14)24-17-12-8-15(9-13-17)22-20(23)18-4-2-3-5-19(18)21/h2-13H,1H3,(H,22,23).
What are the key properties of 2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide?
2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide has a molecular weight of 321.35 g/mol, XLogP of 5.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[4-(4-methylphenoxy)phenyl]benzamide is sourced from PubChem (CID 759350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).