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

C20H15F2N3O3 — CID 109093066

IUPAC4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1cccc(NC(=O)c2cc(C(=O)Nc3ccc(F)c(F)c3)ccn2)c1
InChIInChI=1S/C20H15F2N3O3/c1-28-15-4-2-3-13(10-15)25-20(27)18-9-12(7-8-23-18)19(26)24-14-5-6-16(21)17(22)11-14/h2-11H,1H3,(H,24,26)(H,25,27)
InChIKeyHZNLUHVWPGMBIP-UHFFFAOYSA-N
MW383.35 g/mol
LogP3.87
Rot. Bonds5

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

4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109093066) has the molecular formula C20H15F2N3O3 and a molecular weight of 383.35 g/mol. Its IUPAC name is 4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
PubChem CID109093066
Molecular FormulaC20H15F2N3O3
Molecular Weight383.35 g/mol
Exact Mass383.11
IUPAC Name4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1cccc(NC(=O)c2cc(C(=O)Nc3ccc(F)c(F)c3)ccn2)c1
InChIInChI=1S/C20H15F2N3O3/c1-28-15-4-2-3-13(10-15)25-20(27)18-9-12(7-8-23-18)19(26)24-14-5-6-16(21)17(22)11-14/h2-11H,1H3,(H,24,26)(H,25,27)
InChIKeyHZNLUHVWPGMBIP-UHFFFAOYSA-N
XLogP3.87
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.35
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide (CID 109093066) is 4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide is COc1cccc(NC(=O)c2cc(C(=O)Nc3ccc(F)c(F)c3)ccn2)c1.
What is the InChIKey of 4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is HZNLUHVWPGMBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2N3O3/c1-28-15-4-2-3-13(10-15)25-20(27)18-9-12(7-8-23-18)19(26)24-14-5-6-16(21)17(22)11-14/h2-11H,1H3,(H,24,26)(H,25,27).
What are the key properties of 4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 383.35 g/mol, XLogP of 3.87, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109093066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).