N-(2,6-difluoro-3-methylphenyl)propanamide

C10H11F2NO — CID 82820072

IUPACN-(2,6-difluoro-3-methylphenyl)propanamide
SMILESCCC(=O)Nc1c(F)ccc(C)c1F
InChIInChI=1S/C10H11F2NO/c1-3-8(14)13-10-7(11)5-4-6(2)9(10)12/h4-5H,3H2,1-2H3,(H,13,14)
InChIKeyRKOWOLJKJZBJNF-UHFFFAOYSA-N
MW199.20 g/mol
LogP2.62
Rot. Bonds2

About N-(2,6-difluoro-3-methylphenyl)propanamide

N-(2,6-difluoro-3-methylphenyl)propanamide (PubChem CID 82820072) has the molecular formula C10H11F2NO and a molecular weight of 199.20 g/mol. Its IUPAC name is N-(2,6-difluoro-3-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(2,6-difluoro-3-methylphenyl)propanamide
PubChem CID82820072
Molecular FormulaC10H11F2NO
Molecular Weight199.20 g/mol
Exact Mass199.08
IUPAC NameN-(2,6-difluoro-3-methylphenyl)propanamide
SMILESCCC(=O)Nc1c(F)ccc(C)c1F
InChIInChI=1S/C10H11F2NO/c1-3-8(14)13-10-7(11)5-4-6(2)9(10)12/h4-5H,3H2,1-2H3,(H,13,14)
InChIKeyRKOWOLJKJZBJNF-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

3-(2,6-difluoro-3-methylanilino)-3-oxopropanoic acid
CID 82820377
N-(2,6-difluoro-3-hydroxyphenyl)propanamide
CID 170212075
N-(2,6-difluoro-3-methylphenyl)-4-hydroxybutanamide
CID 82819991
4-amino-N-(2,6-difluoro-3-methylphenyl)-4-methylpentanamide
CID 82819149
N-(2,6-difluoro-3-methylphenyl)-2-(prop-2-ynylamino)acetamide
CID 82817941
2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide
CID 82817938
3-(cyclopropylamino)-N-(2,6-difluoro-3-methylphenyl)propanamide
CID 82818657
N-(2,6-difluoro-3-methylphenyl)-2-(3-hydroxyphenyl)acetamide
CID 82819723
2-(5-amino-2-oxo-1-pyridinyl)-N-(2,6-difluoro-3-methylphenyl)acetamide
CID 82800041
3-amino-N-(2,6-difluoro-3-methylphenyl)-3-phenylpropanamide
CID 82801709
N-(4-fluoro-2,6-dimethylphenyl)propanamide;yttrium
CID 159722509
N-(2,6-difluoro-3-methylphenyl)benzamide
CID 82819371

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluoro-3-methylphenyl)propanamide?
The IUPAC name of N-(2,6-difluoro-3-methylphenyl)propanamide (CID 82820072) is N-(2,6-difluoro-3-methylphenyl)propanamide.
What is the SMILES notation for N-(2,6-difluoro-3-methylphenyl)propanamide?
The canonical SMILES for N-(2,6-difluoro-3-methylphenyl)propanamide is CCC(=O)Nc1c(F)ccc(C)c1F.
What is the InChIKey of N-(2,6-difluoro-3-methylphenyl)propanamide?
The InChIKey is RKOWOLJKJZBJNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO/c1-3-8(14)13-10-7(11)5-4-6(2)9(10)12/h4-5H,3H2,1-2H3,(H,13,14).
What are the key properties of N-(2,6-difluoro-3-methylphenyl)propanamide?
N-(2,6-difluoro-3-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-(2,6-difluoro-3-methylphenyl)propanamide is sourced from PubChem (CID 82820072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).