N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide

C20H16FNO2 — CID 16650951

IUPACN-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide
SMILESCc1cccc(Oc2ccc(C(=O)Nc3cccc(F)c3)cc2)c1
InChIInChI=1S/C20H16FNO2/c1-14-4-2-7-19(12-14)24-18-10-8-15(9-11-18)20(23)22-17-6-3-5-16(21)13-17/h2-13H,1H3,(H,22,23)
InChIKeyQBSIFIDPSHETNU-UHFFFAOYSA-N
MW321.35 g/mol
LogP5.18
Rot. Bonds4

About N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide

N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide (PubChem CID 16650951) has the molecular formula C20H16FNO2 and a molecular weight of 321.35 g/mol. Its IUPAC name is N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide
PubChem CID16650951
Molecular FormulaC20H16FNO2
Molecular Weight321.35 g/mol
Exact Mass321.12
IUPAC NameN-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide
SMILESCc1cccc(Oc2ccc(C(=O)Nc3cccc(F)c3)cc2)c1
InChIInChI=1S/C20H16FNO2/c1-14-4-2-7-19(12-14)24-18-10-8-15(9-11-18)20(23)22-17-6-3-5-16(21)13-17/h2-13H,1H3,(H,22,23)
InChIKeyQBSIFIDPSHETNU-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

4-fluoro-N-[4-(3-methylphenoxy)phenyl]benzamide
CID 2114068
N-(3-methylphenyl)-4-[4-[(3-methylphenyl)carbamoyl]phenoxy]benzamide
CID 3539312
N-(3-methylphenyl)-4-phenoxybenzamide
CID 7946520
4-(3-methylphenoxy)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 16650952
N-(4-acetylphenyl)-4-(3-methylphenoxy)benzamide
CID 16650962
N-(4-chlorophenyl)-4-(3-methylphenoxy)benzamide
CID 16650944
4-methyl-N-(3-phenoxyphenyl)benzamide
CID 59304535
4-tert-butyl-N-[4-(3-fluorophenoxy)phenyl]benzamide
CID 142594929
4-[(2,3-dimethyl-1H-indol-5-yl)oxy]-N-(3-fluorophenyl)benzamide
CID 129206342
4-N-(3-fluorophenyl)-1-N-(4-methylphenyl)benzene-1,4-dicarboxamide
CID 109049444
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(3-methylphenoxy)benzamide
CID 16650954
3-fluoro-N-[4-[3-[4-[(3-fluorobenzoyl)amino]phenoxy]phenoxy]phenyl]benzamide
CID 3108222

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide?
The IUPAC name of N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide (CID 16650951) is N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide.
What is the SMILES notation for N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide?
The canonical SMILES for N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide is Cc1cccc(Oc2ccc(C(=O)Nc3cccc(F)c3)cc2)c1.
What is the InChIKey of N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide?
The InChIKey is QBSIFIDPSHETNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FNO2/c1-14-4-2-7-19(12-14)24-18-10-8-15(9-11-18)20(23)22-17-6-3-5-16(21)13-17/h2-13H,1H3,(H,22,23).
What are the key properties of N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide?
N-(3-fluorophenyl)-4-(3-methylphenoxy)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 N-(3-fluorophenyl)-4-(3-methylphenoxy)benzamide is sourced from PubChem (CID 16650951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).