4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide

C14H10F3NO — CID 686471

IUPAC4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide
SMILESCc1cc(F)c(F)cc1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H10F3NO/c1-8-5-12(16)13(17)7-11(8)14(19)18-10-4-2-3-9(15)6-10/h2-7H,1H3,(H,18,19)
InChIKeyJKORNPDHTPAPDK-UHFFFAOYSA-N
MW265.23 g/mol
LogP3.66
Rot. Bonds2

About 4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide

4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide (PubChem CID 686471) has the molecular formula C14H10F3NO and a molecular weight of 265.23 g/mol. Its IUPAC name is 4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide.

Molecular Properties

Compound Name4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide
PubChem CID686471
Molecular FormulaC14H10F3NO
Molecular Weight265.23 g/mol
Exact Mass265.07
IUPAC Name4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide
SMILESCc1cc(F)c(F)cc1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H10F3NO/c1-8-5-12(16)13(17)7-11(8)14(19)18-10-4-2-3-9(15)6-10/h2-7H,1H3,(H,18,19)
InChIKeyJKORNPDHTPAPDK-UHFFFAOYSA-N
XLogP3.66
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.23
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-bromo-N-(3-fluorophenyl)-2-methylbenzamide
CID 65306774
N-(3-fluorophenyl)-2-methyl-5-methylsulfonylbenzamide
CID 9412429
N-(3-fluorophenyl)-2,5-dimethylthiophene-3-carboxamide
CID 18196520
4-N-(3,4-dimethylphenyl)-1-N-(3-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049648
4-N-(3-fluorophenyl)-1-N-(4-methylphenyl)benzene-1,4-dicarboxamide
CID 109049444
2-fluoro-N-(3-fluorophenyl)-5-(hydroxyamino)benzamide
CID 163637360
N-(3-fluorophenyl)-4-methyl-3-(methylamino)benzamide
CID 146654159
N-(3-fluorophenyl)-4-(methylamino)benzamide
CID 62166900
2,3,5,6-tetrafluoro-1-N,4-N-bis(3-fluorophenyl)benzene-1,4-dicarboxamide
CID 3094065
5-(3-aminoprop-1-ynyl)-N-(3-fluorophenyl)-2-methylbenzamide
CID 65310829
2,5-difluoro-N-(3-fluorophenyl)-4-nitrobenzamide
CID 115736115
(3-fluorophenyl)carbamic acid;hydrochloride
CID 70589934

Frequently Asked Questions

What is the IUPAC name of 4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide?
The IUPAC name of 4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide (CID 686471) is 4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide.
What is the SMILES notation for 4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide?
The canonical SMILES for 4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide is Cc1cc(F)c(F)cc1C(=O)Nc1cccc(F)c1.
What is the InChIKey of 4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide?
The InChIKey is JKORNPDHTPAPDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F3NO/c1-8-5-12(16)13(17)7-11(8)14(19)18-10-4-2-3-9(15)6-10/h2-7H,1H3,(H,18,19).
What are the key properties of 4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide?
4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide has a molecular weight of 265.23 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide is sourced from PubChem (CID 686471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).