2-amino-N-(2,6-difluorophenyl)hexanamide

C12H16F2N2O — CID 54928730

IUPAC2-amino-N-(2,6-difluorophenyl)hexanamide
SMILESCCCCC(N)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C12H16F2N2O/c1-2-3-7-10(15)12(17)16-11-8(13)5-4-6-9(11)14/h4-6,10H,2-3,7,15H2,1H3,(H,16,17)
InChIKeyDVWBFJVGFDGOHV-UHFFFAOYSA-N
MW242.27 g/mol
LogP2.42
Rot. Bonds5

About 2-amino-N-(2,6-difluorophenyl)hexanamide

2-amino-N-(2,6-difluorophenyl)hexanamide (PubChem CID 54928730) has the molecular formula C12H16F2N2O and a molecular weight of 242.27 g/mol. Its IUPAC name is 2-amino-N-(2,6-difluorophenyl)hexanamide.

Molecular Properties

Compound Name2-amino-N-(2,6-difluorophenyl)hexanamide
PubChem CID54928730
Molecular FormulaC12H16F2N2O
Molecular Weight242.27 g/mol
Exact Mass242.12
IUPAC Name2-amino-N-(2,6-difluorophenyl)hexanamide
SMILESCCCCC(N)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C12H16F2N2O/c1-2-3-7-10(15)12(17)16-11-8(13)5-4-6-9(11)14/h4-6,10H,2-3,7,15H2,1H3,(H,16,17)
InChIKeyDVWBFJVGFDGOHV-UHFFFAOYSA-N
XLogP2.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(2-fluoro-6-methylphenyl)hexanamide
CID 107146650
(2S)-2-amino-N-(2-fluoro-6-nitrophenyl)hexanamide
CID 107146091
(2S)-2-amino-N-(2,4,6-trifluorophenyl)hexanamide
CID 107145817
(2S)-2-amino-N-(2,6-diethylphenyl)hexanamide
CID 107143829
(2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide
CID 107570747
(2S)-2-amino-N-(2-chloro-6-methylphenyl)hexanamide
CID 107145880
(2S)-2-amino-N-(2,6-dichloro-4-fluorophenyl)hexanamide
CID 107146373
(2S)-2-amino-N-(2-methyl-6-propan-2-ylphenyl)hexanamide
CID 103830899
2-amino-N-(2,6-difluorophenyl)propanamide
CID 43087644
2-amino-N-(2-bromo-6-fluorophenyl)butanamide
CID 107599827
N-(3-acetamidophenyl)-2-aminohexanamide
CID 60852572
(2S)-2-amino-N-(4-chloro-2-fluorophenyl)hexanamide
CID 103830888

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,6-difluorophenyl)hexanamide?
The IUPAC name of 2-amino-N-(2,6-difluorophenyl)hexanamide (CID 54928730) is 2-amino-N-(2,6-difluorophenyl)hexanamide.
What is the SMILES notation for 2-amino-N-(2,6-difluorophenyl)hexanamide?
The canonical SMILES for 2-amino-N-(2,6-difluorophenyl)hexanamide is CCCCC(N)C(=O)Nc1c(F)cccc1F.
What is the InChIKey of 2-amino-N-(2,6-difluorophenyl)hexanamide?
The InChIKey is DVWBFJVGFDGOHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F2N2O/c1-2-3-7-10(15)12(17)16-11-8(13)5-4-6-9(11)14/h4-6,10H,2-3,7,15H2,1H3,(H,16,17).
What are the key properties of 2-amino-N-(2,6-difluorophenyl)hexanamide?
2-amino-N-(2,6-difluorophenyl)hexanamide has a molecular weight of 242.27 g/mol, XLogP of 2.42, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,6-difluorophenyl)hexanamide is sourced from PubChem (CID 54928730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).