2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide

C21H17F2N3O2 — CID 109092288

IUPAC2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
SMILESCCc1ccc(NC(=O)c2ccnc(C(=O)Nc3ccc(F)c(F)c3)c2)cc1
InChIInChI=1S/C21H17F2N3O2/c1-2-13-3-5-15(6-4-13)25-20(27)14-9-10-24-19(11-14)21(28)26-16-7-8-17(22)18(23)12-16/h3-12H,2H2,1H3,(H,25,27)(H,26,28)
InChIKeyXMZRACZPWJAXIO-UHFFFAOYSA-N
MW381.38 g/mol
LogP4.43
Rot. Bonds5

About 2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide

2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109092288) has the molecular formula C21H17F2N3O2 and a molecular weight of 381.38 g/mol. Its IUPAC name is 2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109092288
Molecular FormulaC21H17F2N3O2
Molecular Weight381.38 g/mol
Exact Mass381.13
IUPAC Name2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
SMILESCCc1ccc(NC(=O)c2ccnc(C(=O)Nc3ccc(F)c(F)c3)c2)cc1
InChIInChI=1S/C21H17F2N3O2/c1-2-13-3-5-15(6-4-13)25-20(27)14-9-10-24-19(11-14)21(28)26-16-7-8-17(22)18(23)12-16/h3-12H,2H2,1H3,(H,25,27)(H,26,28)
InChIKeyXMZRACZPWJAXIO-UHFFFAOYSA-N
XLogP4.43
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.38
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(2,4-difluorophenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092315
4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092310
2-N-(3,4-difluorophenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109093279
2-N-(4-ethylphenyl)-4-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091133
2-N-butan-2-yl-4-N-(3,4-difluorophenyl)pyridine-2,4-dicarboxamide
CID 109080310
2-N-(3,4-difluorophenyl)-4-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091189
2-N-tert-butyl-4-N-(3,4-difluorophenyl)pyridine-2,4-dicarboxamide
CID 109089355
4-N-(4-ethylphenyl)-2-N-propylpyridine-2,4-dicarboxamide
CID 109077915
4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093066
N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide
CID 109198480
4-N-(3,4-difluorophenyl)-2-N-(3-methoxypropyl)pyridine-2,4-dicarboxamide
CID 109082791
4-N-(3-chloro-4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091357

Frequently Asked Questions

What is the IUPAC name of 2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide (CID 109092288) is 2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide is CCc1ccc(NC(=O)c2ccnc(C(=O)Nc3ccc(F)c(F)c3)c2)cc1.
What is the InChIKey of 2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is XMZRACZPWJAXIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17F2N3O2/c1-2-13-3-5-15(6-4-13)25-20(27)14-9-10-24-19(11-14)21(28)26-16-7-8-17(22)18(23)12-16/h3-12H,2H2,1H3,(H,25,27)(H,26,28).
What are the key properties of 2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide?
2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 381.38 g/mol, XLogP of 4.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109092288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).