3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide

C25H19FN2O2 — CID 11646958

IUPAC3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2cc(F)cc(-c3ccc(-c4ccccc4)cc3)c2)cn1
InChIInChI=1S/C25H19FN2O2/c1-30-24-12-11-23(16-27-24)28-25(29)21-13-20(14-22(26)15-21)19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-16H,1H3,(H,28,29)
InChIKeyNBCMATNGASIFHH-UHFFFAOYSA-N
MW398.44 g/mol
LogP5.82
Rot. Bonds5

About 3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide

3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide (PubChem CID 11646958) has the molecular formula C25H19FN2O2 and a molecular weight of 398.44 g/mol. Its IUPAC name is 3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide.

Molecular Properties

Compound Name3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide
PubChem CID11646958
Molecular FormulaC25H19FN2O2
Molecular Weight398.44 g/mol
Exact Mass398.14
IUPAC Name3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2cc(F)cc(-c3ccc(-c4ccccc4)cc3)c2)cn1
InChIInChI=1S/C25H19FN2O2/c1-30-24-12-11-23(16-27-24)28-25(29)21-13-20(14-22(26)15-21)19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-16H,1H3,(H,28,29)
InChIKeyNBCMATNGASIFHH-UHFFFAOYSA-N
XLogP5.82
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.44
LogP ≤ 55.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-fluorophenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
CID 68548529
3,5-diamino-N-(6-methoxy-3-pyridinyl)benzamide
CID 61090732
6-methoxy-N-phenylpyridine-3-carboxamide
CID 44512975
4-bromo-3-fluoro-N-(6-methoxy-3-pyridinyl)benzamide
CID 47421902
N-(6-methoxy-3-pyridinyl)-2-oxo-1H-pyridine-4-carboxamide
CID 113257121
3,4,5-triethoxy-N-(6-methoxy-3-pyridinyl)benzamide
CID 7478549
3-carbamothioyl-N-(6-methoxy-3-pyridinyl)benzamide
CID 24707094
4-bromo-N-[6-(4-fluorophenoxy)-3-pyridinyl]-3,5-dimethoxybenzamide
CID 55713973
6-amino-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
CID 62060168
N-[3-(4,6-dimethoxypyrimidin-2-yl)phenyl]-4-phenylbenzamide
CID 5018775
4-butoxy-N-(6-methoxy-3-pyridinyl)benzamide
CID 7478576
4-fluoro-N-[3-(6-methoxypyridazin-3-yl)phenyl]benzamide
CID 7422514

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide?
The IUPAC name of 3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide (CID 11646958) is 3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide.
What is the SMILES notation for 3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide?
The canonical SMILES for 3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide is COc1ccc(NC(=O)c2cc(F)cc(-c3ccc(-c4ccccc4)cc3)c2)cn1.
What is the InChIKey of 3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide?
The InChIKey is NBCMATNGASIFHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19FN2O2/c1-30-24-12-11-23(16-27-24)28-25(29)21-13-20(14-22(26)15-21)19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-16H,1H3,(H,28,29).
What are the key properties of 3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide?
3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide has a molecular weight of 398.44 g/mol, XLogP of 5.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(6-methoxy-3-pyridinyl)-5-(4-phenylphenyl)benzamide is sourced from PubChem (CID 11646958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).