3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide

C22H19F2N3O2 — CID 109109045

IUPAC3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide
SMILESCCN(C(=O)c1cncc(C(=O)Nc2ccc(F)cc2F)c1)c1cccc(C)c1
InChIInChI=1S/C22H19F2N3O2/c1-3-27(18-6-4-5-14(2)9-18)22(29)16-10-15(12-25-13-16)21(28)26-20-8-7-17(23)11-19(20)24/h4-13H,3H2,1-2H3,(H,26,28)
InChIKeyGOVGAIKGSMUVNV-UHFFFAOYSA-N
MW395.41 g/mol
LogP4.59
Rot. Bonds5

About 3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide

3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide (PubChem CID 109109045) has the molecular formula C22H19F2N3O2 and a molecular weight of 395.41 g/mol. Its IUPAC name is 3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide
PubChem CID109109045
Molecular FormulaC22H19F2N3O2
Molecular Weight395.41 g/mol
Exact Mass395.14
IUPAC Name3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide
SMILESCCN(C(=O)c1cncc(C(=O)Nc2ccc(F)cc2F)c1)c1cccc(C)c1
InChIInChI=1S/C22H19F2N3O2/c1-3-27(18-6-4-5-14(2)9-18)22(29)16-10-15(12-25-13-16)21(28)26-20-8-7-17(23)11-19(20)24/h4-13H,3H2,1-2H3,(H,26,28)
InChIKeyGOVGAIKGSMUVNV-UHFFFAOYSA-N
XLogP4.59
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.41
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-ethyl-1-N-(2-fluorophenyl)-3-N-(3-methylphenyl)benzene-1,3-dicarboxamide
CID 109057447
3-N-(3-chlorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide
CID 109108801
3-N-(2,4-difluorophenyl)-5-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 109107640
5-N-ethyl-3-N-(3-fluorophenyl)-5-N-phenylpyridine-3,5-dicarboxamide
CID 109108560
5-N-ethyl-5-N-(3-methylphenyl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105164
3-N-ethyl-1-N-(2-fluorophenyl)-3-N-phenylbenzene-1,3-dicarboxamide
CID 109057333
5-[3-(dimethylamino)propylamino]-N-ethyl-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109230056
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109242767
4-N-(2,4-difluorophenyl)-1-N-[(3-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046917
5-N-(2,4-difluorophenyl)-3-N-(pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide
CID 109106175
N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide
CID 115745612
5-N-(2,4-difluorophenyl)-3-N-(pyridin-3-ylmethyl)pyridine-3,5-dicarboxamide
CID 109106077

Frequently Asked Questions

What is the IUPAC name of 3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide (CID 109109045) is 3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide is CCN(C(=O)c1cncc(C(=O)Nc2ccc(F)cc2F)c1)c1cccc(C)c1.
What is the InChIKey of 3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide?
The InChIKey is GOVGAIKGSMUVNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19F2N3O2/c1-3-27(18-6-4-5-14(2)9-18)22(29)16-10-15(12-25-13-16)21(28)26-20-8-7-17(23)11-19(20)24/h4-13H,3H2,1-2H3,(H,26,28).
What are the key properties of 3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide?
3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide has a molecular weight of 395.41 g/mol, XLogP of 4.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2,4-difluorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109109045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).