4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide

C22H19F2N3O2 — CID 109092464

IUPAC4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
SMILESCC(C)c1ccccc1NC(=O)c1cc(C(=O)Nc2ccc(F)c(F)c2)ccn1
InChIInChI=1S/C22H19F2N3O2/c1-13(2)16-5-3-4-6-19(16)27-22(29)20-11-14(9-10-25-20)21(28)26-15-7-8-17(23)18(24)12-15/h3-13H,1-2H3,(H,26,28)(H,27,29)
InChIKeyUUNQGQFVDCYSOS-UHFFFAOYSA-N
MW395.41 g/mol
LogP4.99
Rot. Bonds5

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

4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109092464) has the molecular formula C22H19F2N3O2 and a molecular weight of 395.41 g/mol. Its IUPAC name is 4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109092464
Molecular FormulaC22H19F2N3O2
Molecular Weight395.41 g/mol
Exact Mass395.14
IUPAC Name4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
SMILESCC(C)c1ccccc1NC(=O)c1cc(C(=O)Nc2ccc(F)c(F)c2)ccn1
InChIInChI=1S/C22H19F2N3O2/c1-13(2)16-5-3-4-6-19(16)27-22(29)20-11-14(9-10-25-20)21(28)26-15-7-8-17(23)18(24)12-15/h3-13H,1-2H3,(H,26,28)(H,27,29)
InChIKeyUUNQGQFVDCYSOS-UHFFFAOYSA-N
XLogP4.99
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.41
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-[(2-fluorophenyl)methyl]-4-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109086448
2-N-(3,4-difluorophenyl)-4-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091189
2-N-(3,4-difluorophenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109093279
4-N-(3-chloro-4-fluorophenyl)-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092643
2-N-(3-chloro-4-fluorophenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091011
2-N-butan-2-yl-4-N-(3,4-difluorophenyl)pyridine-2,4-dicarboxamide
CID 109080310
4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093066
4-N-(3,4-dimethylphenyl)-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109091879
2-N-(2-fluorophenyl)-4-N-(4-propan-2-yloxyphenyl)pyridine-2,4-dicarboxamide
CID 109092654
2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092288
2-N-tert-butyl-4-N-(3,4-difluorophenyl)pyridine-2,4-dicarboxamide
CID 109089355
2-N-(3-chlorophenyl)-4-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092592

Frequently Asked Questions

What is the IUPAC name of 4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide (CID 109092464) is 4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide is CC(C)c1ccccc1NC(=O)c1cc(C(=O)Nc2ccc(F)c(F)c2)ccn1.
What is the InChIKey of 4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is UUNQGQFVDCYSOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19F2N3O2/c1-13(2)16-5-3-4-6-19(16)27-22(29)20-11-14(9-10-25-20)21(28)26-15-7-8-17(23)18(24)12-15/h3-13H,1-2H3,(H,26,28)(H,27,29).
What are the key properties of 4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 395.41 g/mol, XLogP of 4.99, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(3,4-difluorophenyl)-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109092464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).