5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide

C21H18FN3O2 — CID 109106222

IUPAC5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
SMILESO=C(NCCc1ccccc1)c1cncc(C(=O)Nc2ccccc2F)c1
InChIInChI=1S/C21H18FN3O2/c22-18-8-4-5-9-19(18)25-21(27)17-12-16(13-23-14-17)20(26)24-11-10-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2,(H,24,26)(H,25,27)
InChIKeyHBZOTYOORBOVAM-UHFFFAOYSA-N
MW363.39 g/mol
LogP3.45
Rot. Bonds6

About 5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide

5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide (PubChem CID 109106222) has the molecular formula C21H18FN3O2 and a molecular weight of 363.39 g/mol. Its IUPAC name is 5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
PubChem CID109106222
Molecular FormulaC21H18FN3O2
Molecular Weight363.39 g/mol
Exact Mass363.14
IUPAC Name5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
SMILESO=C(NCCc1ccccc1)c1cncc(C(=O)Nc2ccccc2F)c1
InChIInChI=1S/C21H18FN3O2/c22-18-8-4-5-9-19(18)25-21(27)17-12-16(13-23-14-17)20(26)24-11-10-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2,(H,24,26)(H,25,27)
InChIKeyHBZOTYOORBOVAM-UHFFFAOYSA-N
XLogP3.45
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.39
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-butyl-5-N-(2-fluorophenyl)pyridine-3,5-dicarboxamide
CID 109102018
5-N-(3-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109106241
3-N-[2-(4-fluorophenyl)ethyl]-5-N-phenylpyridine-3,5-dicarboxamide
CID 109106358
5-N-(2-fluorophenyl)-3-N-(3-methoxypropyl)pyridine-3,5-dicarboxamide
CID 109103653
5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 46033116
5-(2-fluoroanilino)-N-(3-phenylpropyl)pyridine-3-carboxamide
CID 109239035
3-N-[2-(2-fluorophenyl)ethyl]-5-N-(2-methylphenyl)pyridine-3,5-dicarboxamide
CID 109106318
5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109106239
5-(2,4-difluoroanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109235876
5-N-(3-methylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109106204
5-N-(2-fluorophenyl)-3-N-(pyridin-2-ylmethyl)pyridine-3,5-dicarboxamide
CID 109105942
3-N-(2-phenylethyl)-5-N-prop-2-enylpyridine-3,5-dicarboxamide
CID 109101755

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide (CID 109106222) is 5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide is O=C(NCCc1ccccc1)c1cncc(C(=O)Nc2ccccc2F)c1.
What is the InChIKey of 5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
The InChIKey is HBZOTYOORBOVAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FN3O2/c22-18-8-4-5-9-19(18)25-21(27)17-12-16(13-23-14-17)20(26)24-11-10-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2,(H,24,26)(H,25,27).
What are the key properties of 5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide has a molecular weight of 363.39 g/mol, XLogP of 3.45, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109106222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).