5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide

C21H18FN3O2 — CID 109108560

IUPAC5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide
SMILESCCN(C(=O)c1cncc(C(=O)Nc2cccc(F)c2)c1)c1ccccc1
InChIInChI=1S/C21H18FN3O2/c1-2-25(19-9-4-3-5-10-19)21(27)16-11-15(13-23-14-16)20(26)24-18-8-6-7-17(22)12-18/h3-14H,2H2,1H3,(H,24,26)
InChIKeyVANUXVVPQVXOHY-UHFFFAOYSA-N
MW363.39 g/mol
LogP4.14
Rot. Bonds5

About 5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide

5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide (PubChem CID 109108560) has the molecular formula C21H18FN3O2 and a molecular weight of 363.39 g/mol. Its IUPAC name is 5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide
PubChem CID109108560
Molecular FormulaC21H18FN3O2
Molecular Weight363.39 g/mol
Exact Mass363.14
IUPAC Name5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide
SMILESCCN(C(=O)c1cncc(C(=O)Nc2cccc(F)c2)c1)c1ccccc1
InChIInChI=1S/C21H18FN3O2/c1-2-25(19-9-4-3-5-10-19)21(27)16-11-15(13-23-14-16)20(26)24-18-8-6-7-17(22)12-18/h3-14H,2H2,1H3,(H,24,26)
InChIKeyVANUXVVPQVXOHY-UHFFFAOYSA-N
XLogP4.14
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.39
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-ethyl-4-N-(3-fluorophenyl)-2-N-phenylpyridine-2,4-dicarboxamide
CID 109092385
N-[3-[ethyl(phenyl)carbamoyl]phenyl]pyridine-4-carboxamide
CID 17221980
3-N-(3-chlorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide
CID 109108801
5-N-(3-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109106241
3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide
CID 109109045
4-N-ethyl-1-N,4-N-diphenylbenzene-1,4-dicarboxamide
CID 109049216
1-N-(3-cyanophenyl)-4-N-ethyl-4-N-phenylbenzene-1,4-dicarboxamide
CID 109049797
N-ethyl-5-(3-methylanilino)-N-phenylpyridine-3-carboxamide
CID 109241929
5-N-ethyl-3-N-[(4-methylphenyl)methyl]-5-N-phenylpyridine-3,5-dicarboxamide
CID 109105299
N-(3-acetamidophenyl)-5-(N-ethylanilino)pyridine-3-carboxamide
CID 109243646
3-N-cycloheptyl-5-N-ethyl-5-N-phenylpyridine-3,5-dicarboxamide
CID 109107040
5-(3-chloroanilino)-N-ethyl-N-phenylpyridine-3-carboxamide
CID 109243553

Frequently Asked Questions

What is the IUPAC name of 5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide (CID 109108560) is 5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide is CCN(C(=O)c1cncc(C(=O)Nc2cccc(F)c2)c1)c1ccccc1.
What is the InChIKey of 5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide?
The InChIKey is VANUXVVPQVXOHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FN3O2/c1-2-25(19-9-4-3-5-10-19)21(27)16-11-15(13-23-14-16)20(26)24-18-8-6-7-17(22)12-18/h3-14H,2H2,1H3,(H,24,26).
What are the key properties of 5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide?
5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide has a molecular weight of 363.39 g/mol, XLogP of 4.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide is sourced from PubChem (CID 109108560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).