N,N-dibenzyl-2,6-difluorobenzamide

C21H17F2NO — CID 2321718

IUPACN,N-dibenzyl-2,6-difluorobenzamide
SMILESO=C(c1c(F)cccc1F)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H17F2NO/c22-18-12-7-13-19(23)20(18)21(25)24(14-16-8-3-1-4-9-16)15-17-10-5-2-6-11-17/h1-13H,14-15H2
InChIKeyCAHHPOXZQLDBDV-UHFFFAOYSA-N
MW337.37 g/mol
LogP4.81
Rot. Bonds5

About N,N-dibenzyl-2,6-difluorobenzamide

N,N-dibenzyl-2,6-difluorobenzamide (PubChem CID 2321718) has the molecular formula C21H17F2NO and a molecular weight of 337.37 g/mol. Its IUPAC name is N,N-dibenzyl-2,6-difluorobenzamide.

Molecular Properties

Compound NameN,N-dibenzyl-2,6-difluorobenzamide
PubChem CID2321718
Molecular FormulaC21H17F2NO
Molecular Weight337.37 g/mol
Exact Mass337.13
IUPAC NameN,N-dibenzyl-2,6-difluorobenzamide
SMILESO=C(c1c(F)cccc1F)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H17F2NO/c22-18-12-7-13-19(23)20(18)21(25)24(14-16-8-3-1-4-9-16)15-17-10-5-2-6-11-17/h1-13H,14-15H2
InChIKeyCAHHPOXZQLDBDV-UHFFFAOYSA-N
XLogP4.81
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.37
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-2,6-difluorobenzamide?
The IUPAC name of N,N-dibenzyl-2,6-difluorobenzamide (CID 2321718) is N,N-dibenzyl-2,6-difluorobenzamide.
What is the SMILES notation for N,N-dibenzyl-2,6-difluorobenzamide?
The canonical SMILES for N,N-dibenzyl-2,6-difluorobenzamide is O=C(c1c(F)cccc1F)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzyl-2,6-difluorobenzamide?
The InChIKey is CAHHPOXZQLDBDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17F2NO/c22-18-12-7-13-19(23)20(18)21(25)24(14-16-8-3-1-4-9-16)15-17-10-5-2-6-11-17/h1-13H,14-15H2.
What are the key properties of N,N-dibenzyl-2,6-difluorobenzamide?
N,N-dibenzyl-2,6-difluorobenzamide has a molecular weight of 337.37 g/mol, XLogP of 4.81, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-2,6-difluorobenzamide is sourced from PubChem (CID 2321718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).