3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide

C22H15FN2O — CID 46376278

IUPAC3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide
SMILESO=C(Nc1cccc(-c2ccc3ccccc3n2)c1)c1cccc(F)c1
InChIInChI=1S/C22H15FN2O/c23-18-8-3-7-17(13-18)22(26)24-19-9-4-6-16(14-19)21-12-11-15-5-1-2-10-20(15)25-21/h1-14H,(H,24,26)
InChIKeyYQIZACDFEJRFJY-UHFFFAOYSA-N
MW342.37 g/mol
LogP5.29
Rot. Bonds3

About 3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide

3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide (PubChem CID 46376278) has the molecular formula C22H15FN2O and a molecular weight of 342.37 g/mol. Its IUPAC name is 3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide.

Molecular Properties

Compound Name3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide
PubChem CID46376278
Molecular FormulaC22H15FN2O
Molecular Weight342.37 g/mol
Exact Mass342.12
IUPAC Name3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide
SMILESO=C(Nc1cccc(-c2ccc3ccccc3n2)c1)c1cccc(F)c1
InChIInChI=1S/C22H15FN2O/c23-18-8-3-7-17(13-18)22(26)24-19-9-4-6-16(14-19)21-12-11-15-5-1-2-10-20(15)25-21/h1-14H,(H,24,26)
InChIKeyYQIZACDFEJRFJY-UHFFFAOYSA-N
XLogP5.29
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.37
LogP ≤ 55.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-N-[3-(6-oxo-1H-pyridazin-3-yl)phenyl]benzamide
CID 49035357
3-quinolin-2-ylbenzohydrazide
CID 174752965
2-phenyl-N-(3-quinolin-2-ylphenyl)acetamide
CID 46376277
N'-(3-fluorobenzoyl)quinoline-2-carbohydrazide
CID 35063560
3-chloro-N-[3-[6-(4-fluorophenyl)-2-pyridinyl]phenyl]benzamide
CID 46090638
4-(1,1-dioxothiazinan-2-yl)-N-(3-quinolin-2-ylphenyl)benzamide
CID 90129813
4-chloro-N-[3-(6-methylquinolin-2-yl)phenyl]benzamide
CID 74763620
3-fluoro-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide
CID 7080166
[3-[(3-fluorobenzoyl)amino]phenyl]boronic acid
CID 131251143
3-methyl-N-(3-quinoxalin-2-ylphenyl)benzamide
CID 2224328
2-[4-(3-fluorophenyl)phenyl]quinoline
CID 171056461
6-(3-fluorophenyl)-N-phenylpyridine-3-carboxamide
CID 53111120

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide?
The IUPAC name of 3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide (CID 46376278) is 3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide.
What is the SMILES notation for 3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide?
The canonical SMILES for 3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide is O=C(Nc1cccc(-c2ccc3ccccc3n2)c1)c1cccc(F)c1.
What is the InChIKey of 3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide?
The InChIKey is YQIZACDFEJRFJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15FN2O/c23-18-8-3-7-17(13-18)22(26)24-19-9-4-6-16(14-19)21-12-11-15-5-1-2-10-20(15)25-21/h1-14H,(H,24,26).
What are the key properties of 3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide?
3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide has a molecular weight of 342.37 g/mol, XLogP of 5.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(3-quinolin-2-ylphenyl)benzamide is sourced from PubChem (CID 46376278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).