2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide

C20H15F2N3O2 — CID 109097324

IUPAC2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide
SMILESO=C(NCc1ccccc1)c1cccc(C(=O)Nc2c(F)cccc2F)n1
InChIInChI=1S/C20H15F2N3O2/c21-14-8-4-9-15(22)18(14)25-20(27)17-11-5-10-16(24-17)19(26)23-12-13-6-2-1-3-7-13/h1-11H,12H2,(H,23,26)(H,25,27)
InChIKeyWHFMVPXWKKHKBG-UHFFFAOYSA-N
MW367.36 g/mol
LogP3.54
Rot. Bonds5

About 2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide

2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide (PubChem CID 109097324) has the molecular formula C20H15F2N3O2 and a molecular weight of 367.36 g/mol. Its IUPAC name is 2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide
PubChem CID109097324
Molecular FormulaC20H15F2N3O2
Molecular Weight367.36 g/mol
Exact Mass367.11
IUPAC Name2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide
SMILESO=C(NCc1ccccc1)c1cccc(C(=O)Nc2c(F)cccc2F)n1
InChIInChI=1S/C20H15F2N3O2/c21-14-8-4-9-15(22)18(14)25-20(27)17-11-5-10-16(24-17)19(26)23-12-13-6-2-1-3-7-13/h1-11H,12H2,(H,23,26)(H,25,27)
InChIKeyWHFMVPXWKKHKBG-UHFFFAOYSA-N
XLogP3.54
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.36
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-benzyl-5-N-(2,6-difluorophenyl)pyridine-3,5-dicarboxamide
CID 109105081
2-N-benzyl-6-N-(4-methylphenyl)pyridine-2,6-dicarboxamide
CID 109097257
N-benzyl-6-(chloromethyl)pyridine-2-carboxamide
CID 67806614
2-N,6-N-bis[(3-fluorophenyl)methyl]pyridine-2,6-dicarboxamide
CID 20929906
6-amino-N-benzylpyridine-2-carboxamide
CID 62240949
2-N-[(4-chlorophenyl)methyl]-6-N-(4-fluorophenyl)pyridine-2,6-dicarboxamide
CID 109097951
2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
CID 109094402
2-N-benzyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097211
methyl 4-[[6-(benzylcarbamoyl)pyridine-2-carbonyl]amino]benzoate
CID 109097311
6-N-(3,4-difluorophenyl)-2-N-(pyridin-4-ylmethyl)pyridine-2,6-dicarboxamide
CID 109098412
6-fluoro-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 115496596
6-N-(3-fluorophenyl)-2-N-[(4-fluorophenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097871

Frequently Asked Questions

What is the IUPAC name of 2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide (CID 109097324) is 2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide is O=C(NCc1ccccc1)c1cccc(C(=O)Nc2c(F)cccc2F)n1.
What is the InChIKey of 2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide?
The InChIKey is WHFMVPXWKKHKBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2N3O2/c21-14-8-4-9-15(22)18(14)25-20(27)17-11-5-10-16(24-17)19(26)23-12-13-6-2-1-3-7-13/h1-11H,12H2,(H,23,26)(H,25,27).
What are the key properties of 2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide?
2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide has a molecular weight of 367.36 g/mol, XLogP of 3.54, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-benzyl-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109097324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).