4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide

C20H16FN3O2 — CID 109091349

IUPAC4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1ccc(NC(=O)c2cc(C(=O)Nc3ccc(F)cc3)ccn2)cc1
InChIInChI=1S/C20H16FN3O2/c1-13-2-6-16(7-3-13)24-20(26)18-12-14(10-11-22-18)19(25)23-17-8-4-15(21)5-9-17/h2-12H,1H3,(H,23,25)(H,24,26)
InChIKeyLLLUWGRPDHHSQQ-UHFFFAOYSA-N
MW349.37 g/mol
LogP4.03
Rot. Bonds4

About 4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide

4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109091349) has the molecular formula C20H16FN3O2 and a molecular weight of 349.37 g/mol. Its IUPAC name is 4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109091349
Molecular FormulaC20H16FN3O2
Molecular Weight349.37 g/mol
Exact Mass349.12
IUPAC Name4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1ccc(NC(=O)c2cc(C(=O)Nc3ccc(F)cc3)ccn2)cc1
InChIInChI=1S/C20H16FN3O2/c1-13-2-6-16(7-3-13)24-20(26)18-12-14(10-11-22-18)19(25)23-17-8-4-15(21)5-9-17/h2-12H,1H3,(H,23,25)(H,24,26)
InChIKeyLLLUWGRPDHHSQQ-UHFFFAOYSA-N
XLogP4.03
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.37
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide (CID 109091349) is 4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide is Cc1ccc(NC(=O)c2cc(C(=O)Nc3ccc(F)cc3)ccn2)cc1.
What is the InChIKey of 4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is LLLUWGRPDHHSQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN3O2/c1-13-2-6-16(7-3-13)24-20(26)18-12-14(10-11-22-18)19(25)23-17-8-4-15(21)5-9-17/h2-12H,1H3,(H,23,25)(H,24,26).
What are the key properties of 4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide?
4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 349.37 g/mol, XLogP of 4.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109091349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).