2-(2,6-difluoroanilino)-N,N-dimethylpropanamide

C11H14F2N2O — CID 43088763

IUPAC2-(2,6-difluoroanilino)-N,N-dimethylpropanamide
SMILESCC(Nc1c(F)cccc1F)C(=O)N(C)C
InChIInChI=1S/C11H14F2N2O/c1-7(11(16)15(2)3)14-10-8(12)5-4-6-9(10)13/h4-7,14H,1-3H3
InChIKeyBDVZHZABTIDJHF-UHFFFAOYSA-N
MW228.24 g/mol
LogP1.85
Rot. Bonds3

About 2-(2,6-difluoroanilino)-N,N-dimethylpropanamide

2-(2,6-difluoroanilino)-N,N-dimethylpropanamide (PubChem CID 43088763) has the molecular formula C11H14F2N2O and a molecular weight of 228.24 g/mol. Its IUPAC name is 2-(2,6-difluoroanilino)-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-(2,6-difluoroanilino)-N,N-dimethylpropanamide
PubChem CID43088763
Molecular FormulaC11H14F2N2O
Molecular Weight228.24 g/mol
Exact Mass228.11
IUPAC Name2-(2,6-difluoroanilino)-N,N-dimethylpropanamide
SMILESCC(Nc1c(F)cccc1F)C(=O)N(C)C
InChIInChI=1S/C11H14F2N2O/c1-7(11(16)15(2)3)14-10-8(12)5-4-6-9(10)13/h4-7,14H,1-3H3
InChIKeyBDVZHZABTIDJHF-UHFFFAOYSA-N
XLogP1.85
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.24
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-6-fluoroanilino)-N,N-dimethylpropanamide
CID 107599321
2-(2-cyano-3-fluoroanilino)-N,N-dimethylpropanamide
CID 43580682
2-(2,6-difluoroanilino)-N-(2-methylpropyl)propanamide
CID 43088760
N,N-dimethyl-2-(3-methylanilino)propanamide
CID 43085843
2-(2,6-difluoroanilino)-N'-hydroxypropanimidamide
CID 77028561
(2S)-2-[1-(2-chloro-6-fluorophenyl)ethylcarbamoylamino]-N,N-dimethylpropanamide
CID 91662685
2-[4-fluoro-3-(trifluoromethyl)anilino]-N,N-dimethylpropanamide
CID 61227651
N-[1-(dimethylamino)-3-methyl-1-oxobutan-2-yl]-2,6-difluorobenzamide
CID 42910277
2-[[2-(2-fluoroanilino)-2-oxoethyl]amino]-N,N-dimethylpropanamide
CID 61464633
2-(2-amino-4-fluoroanilino)-N,N-dimethylpropanamide
CID 61464114
6-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]pyridine-2-carboxylic acid
CID 55053417
2-(4-carbamothioyl-2-fluoroanilino)-N,N-dimethylpropanamide
CID 54950945

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluoroanilino)-N,N-dimethylpropanamide?
The IUPAC name of 2-(2,6-difluoroanilino)-N,N-dimethylpropanamide (CID 43088763) is 2-(2,6-difluoroanilino)-N,N-dimethylpropanamide.
What is the SMILES notation for 2-(2,6-difluoroanilino)-N,N-dimethylpropanamide?
The canonical SMILES for 2-(2,6-difluoroanilino)-N,N-dimethylpropanamide is CC(Nc1c(F)cccc1F)C(=O)N(C)C.
What is the InChIKey of 2-(2,6-difluoroanilino)-N,N-dimethylpropanamide?
The InChIKey is BDVZHZABTIDJHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2O/c1-7(11(16)15(2)3)14-10-8(12)5-4-6-9(10)13/h4-7,14H,1-3H3.
What are the key properties of 2-(2,6-difluoroanilino)-N,N-dimethylpropanamide?
2-(2,6-difluoroanilino)-N,N-dimethylpropanamide has a molecular weight of 228.24 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluoroanilino)-N,N-dimethylpropanamide is sourced from PubChem (CID 43088763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).