2,2-difluoro-2-quinolin-6-ylacetamide

C11H8F2N2O — CID 175897040

IUPAC2,2-difluoro-2-quinolin-6-ylacetamide
SMILESNC(=O)C(F)(F)c1ccc2ncccc2c1
InChIInChI=1S/C11H8F2N2O/c12-11(13,10(14)16)8-3-4-9-7(6-8)2-1-5-15-9/h1-6H,(H2,14,16)
InChIKeyNCKYELZWAYJOPR-UHFFFAOYSA-N
MW222.19 g/mol
LogP1.81
Rot. Bonds2

About 2,2-difluoro-2-quinolin-6-ylacetamide

2,2-difluoro-2-quinolin-6-ylacetamide (PubChem CID 175897040) has the molecular formula C11H8F2N2O and a molecular weight of 222.19 g/mol. Its IUPAC name is 2,2-difluoro-2-quinolin-6-ylacetamide.

Molecular Properties

Compound Name2,2-difluoro-2-quinolin-6-ylacetamide
PubChem CID175897040
Molecular FormulaC11H8F2N2O
Molecular Weight222.19 g/mol
Exact Mass222.06
IUPAC Name2,2-difluoro-2-quinolin-6-ylacetamide
SMILESNC(=O)C(F)(F)c1ccc2ncccc2c1
InChIInChI=1S/C11H8F2N2O/c12-11(13,10(14)16)8-3-4-9-7(6-8)2-1-5-15-9/h1-6H,(H2,14,16)
InChIKeyNCKYELZWAYJOPR-UHFFFAOYSA-N
XLogP1.81
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.19
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-1-phenyl-2-quinolin-6-ylpropan-1-one
CID 170553040
2-methyl-2-quinolin-6-ylpropanehydrazide
CID 66927115
2,2,2-trifluoro-1-quinolin-6-ylethanone
CID 66466769
2,2,2-trifluoro-1-(2,3,4,5,6-pentafluorophenyl)-1-quinolin-6-ylethanol
CID 2851238
6-tert-butylquinoline;7-tert-butylquinoline
CID 159076219
ethane;quinoline-6-carboxylic acid
CID 91364452
6-(2-methylsulfonylpropan-2-yl)quinoline
CID 91258076
4-[3-[difluoro(quinolin-6-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide
CID 59320375
6-[difluoro([1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]quinoline
CID 122662910
carbonic acid;quinoline
CID 23206844
4-(1-hydroxy-1-quinolin-6-ylethyl)phenol
CID 83076007
N-[[4-(trifluoromethyl)phenyl]methyl]quinoline-6-carboxamide
CID 71822071

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-2-quinolin-6-ylacetamide?
The IUPAC name of 2,2-difluoro-2-quinolin-6-ylacetamide (CID 175897040) is 2,2-difluoro-2-quinolin-6-ylacetamide.
What is the SMILES notation for 2,2-difluoro-2-quinolin-6-ylacetamide?
The canonical SMILES for 2,2-difluoro-2-quinolin-6-ylacetamide is NC(=O)C(F)(F)c1ccc2ncccc2c1.
What is the InChIKey of 2,2-difluoro-2-quinolin-6-ylacetamide?
The InChIKey is NCKYELZWAYJOPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F2N2O/c12-11(13,10(14)16)8-3-4-9-7(6-8)2-1-5-15-9/h1-6H,(H2,14,16).
What are the key properties of 2,2-difluoro-2-quinolin-6-ylacetamide?
2,2-difluoro-2-quinolin-6-ylacetamide has a molecular weight of 222.19 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-2-quinolin-6-ylacetamide is sourced from PubChem (CID 175897040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).