N-(4,5-difluoro-2-methylphenyl)propanamide

C10H11F2NO — CID 154643466

IUPACN-(4,5-difluoro-2-methylphenyl)propanamide
SMILESCCC(=O)Nc1cc(F)c(F)cc1C
InChIInChI=1S/C10H11F2NO/c1-3-10(14)13-9-5-8(12)7(11)4-6(9)2/h4-5H,3H2,1-2H3,(H,13,14)
InChIKeyLKOXGMMFVUPQHI-UHFFFAOYSA-N
MW199.20 g/mol
LogP2.62
Rot. Bonds2

About N-(4,5-difluoro-2-methylphenyl)propanamide

N-(4,5-difluoro-2-methylphenyl)propanamide (PubChem CID 154643466) has the molecular formula C10H11F2NO and a molecular weight of 199.20 g/mol. Its IUPAC name is N-(4,5-difluoro-2-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(4,5-difluoro-2-methylphenyl)propanamide
PubChem CID154643466
Molecular FormulaC10H11F2NO
Molecular Weight199.20 g/mol
Exact Mass199.08
IUPAC NameN-(4,5-difluoro-2-methylphenyl)propanamide
SMILESCCC(=O)Nc1cc(F)c(F)cc1C
InChIInChI=1S/C10H11F2NO/c1-3-10(14)13-9-5-8(12)7(11)4-6(9)2/h4-5H,3H2,1-2H3,(H,13,14)
InChIKeyLKOXGMMFVUPQHI-UHFFFAOYSA-N
XLogP2.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.20
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,4,5-trifluorophenyl)propanamide
CID 63372836
N-(4-iodo-2,5-dimethylphenyl)propanamide
CID 839810
N-(2-fluoro-4-methylphenyl)propanamide
CID 60628124
N-(4-bromo-5-formyl-2-methylphenyl)propanamide
CID 143089766
2-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)acetamide
CID 107591747
N-(4-amino-2-methylphenyl)propanamide
CID 839309
N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)propanamide
CID 2223120
N-(5-bromo-4-fluoro-2-methylphenyl)-2-(methylamino)acetamide
CID 107592352
N-(3,4-difluorophenyl)propanamide
CID 4285365
N-(2-amino-4,5-dimethylphenyl)propanamide
CID 28691521
N-(4-fluoro-2,6-dimethylphenyl)propanamide;yttrium
CID 159722509
N-(2-methyl-4-sulfamoylphenyl)propanamide
CID 43133967

Frequently Asked Questions

What is the IUPAC name of N-(4,5-difluoro-2-methylphenyl)propanamide?
The IUPAC name of N-(4,5-difluoro-2-methylphenyl)propanamide (CID 154643466) is N-(4,5-difluoro-2-methylphenyl)propanamide.
What is the SMILES notation for N-(4,5-difluoro-2-methylphenyl)propanamide?
The canonical SMILES for N-(4,5-difluoro-2-methylphenyl)propanamide is CCC(=O)Nc1cc(F)c(F)cc1C.
What is the InChIKey of N-(4,5-difluoro-2-methylphenyl)propanamide?
The InChIKey is LKOXGMMFVUPQHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO/c1-3-10(14)13-9-5-8(12)7(11)4-6(9)2/h4-5H,3H2,1-2H3,(H,13,14).
What are the key properties of N-(4,5-difluoro-2-methylphenyl)propanamide?
N-(4,5-difluoro-2-methylphenyl)propanamide has a molecular weight of 199.20 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-difluoro-2-methylphenyl)propanamide is sourced from PubChem (CID 154643466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).