N-(2,6-diethylphenyl)-2,4-difluorobenzamide

C17H17F2NO — CID 2495338

IUPACN-(2,6-diethylphenyl)-2,4-difluorobenzamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccc(F)cc1F
InChIInChI=1S/C17H17F2NO/c1-3-11-6-5-7-12(4-2)16(11)20-17(21)14-9-8-13(18)10-15(14)19/h5-10H,3-4H2,1-2H3,(H,20,21)
InChIKeyQAAHWYHRYBBRQR-UHFFFAOYSA-N
MW289.32 g/mol
LogP4.34
Rot. Bonds4

About N-(2,6-diethylphenyl)-2,4-difluorobenzamide

N-(2,6-diethylphenyl)-2,4-difluorobenzamide (PubChem CID 2495338) has the molecular formula C17H17F2NO and a molecular weight of 289.32 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-2,4-difluorobenzamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-2,4-difluorobenzamide
PubChem CID2495338
Molecular FormulaC17H17F2NO
Molecular Weight289.32 g/mol
Exact Mass289.13
IUPAC NameN-(2,6-diethylphenyl)-2,4-difluorobenzamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccc(F)cc1F
InChIInChI=1S/C17H17F2NO/c1-3-11-6-5-7-12(4-2)16(11)20-17(21)14-9-8-13(18)10-15(14)19/h5-10H,3-4H2,1-2H3,(H,20,21)
InChIKeyQAAHWYHRYBBRQR-UHFFFAOYSA-N
XLogP4.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.32
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-bromo-N-(2,6-diethylphenyl)-2-fluorobenzamide
CID 26692195
N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide
CID 115573702
2-chloro-N-(2,6-diethylphenyl)-4,5-difluorobenzamide
CID 1252541
N-(2,6-diethylphenyl)-6-fluoro-1H-indole-3-carboxamide
CID 113206252
N'-(2,6-diethylphenyl)-N-(2,4-difluorophenyl)propanediamide
CID 108954543
2-bromo-N-(2-ethyl-6-methylphenyl)-5-fluorobenzamide
CID 24693167
N-(5-acetamido-2-ethylphenyl)-2,4-difluorobenzamide
CID 108797375
N-(2,6-diethylphenyl)-2,4,5-trimethoxybenzamide
CID 26880577
2,4-difluoro-N-naphthalen-1-ylbenzamide
CID 2981920
1-(2,4-difluorophenyl)-3-(2-ethyl-6-methylphenyl)urea
CID 108991584
2,4-difluoro-N-(3-methylsulfanylphenyl)benzamide
CID 4802933
2-(N-acetyl-2,4-difluoroanilino)-N-(2,6-diethylphenyl)acetamide
CID 113179024

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-2,4-difluorobenzamide?
The IUPAC name of N-(2,6-diethylphenyl)-2,4-difluorobenzamide (CID 2495338) is N-(2,6-diethylphenyl)-2,4-difluorobenzamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-2,4-difluorobenzamide?
The canonical SMILES for N-(2,6-diethylphenyl)-2,4-difluorobenzamide is CCc1cccc(CC)c1NC(=O)c1ccc(F)cc1F.
What is the InChIKey of N-(2,6-diethylphenyl)-2,4-difluorobenzamide?
The InChIKey is QAAHWYHRYBBRQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F2NO/c1-3-11-6-5-7-12(4-2)16(11)20-17(21)14-9-8-13(18)10-15(14)19/h5-10H,3-4H2,1-2H3,(H,20,21).
What are the key properties of N-(2,6-diethylphenyl)-2,4-difluorobenzamide?
N-(2,6-diethylphenyl)-2,4-difluorobenzamide has a molecular weight of 289.32 g/mol, XLogP of 4.34, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-2,4-difluorobenzamide is sourced from PubChem (CID 2495338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).