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

C9H10F2N2O — CID 43087644

IUPAC2-amino-N-(2,6-difluorophenyl)propanamide
SMILESCC(N)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C9H10F2N2O/c1-5(12)9(14)13-8-6(10)3-2-4-7(8)11/h2-5H,12H2,1H3,(H,13,14)
InChIKeyNPJPRBZCAJOQES-UHFFFAOYSA-N
MW200.19 g/mol
LogP1.25
Rot. Bonds2

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

2-amino-N-(2,6-difluorophenyl)propanamide (PubChem CID 43087644) has the molecular formula C9H10F2N2O and a molecular weight of 200.19 g/mol. Its IUPAC name is 2-amino-N-(2,6-difluorophenyl)propanamide.

Molecular Properties

Compound Name2-amino-N-(2,6-difluorophenyl)propanamide
PubChem CID43087644
Molecular FormulaC9H10F2N2O
Molecular Weight200.19 g/mol
Exact Mass200.08
IUPAC Name2-amino-N-(2,6-difluorophenyl)propanamide
SMILESCC(N)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C9H10F2N2O/c1-5(12)9(14)13-8-6(10)3-2-4-7(8)11/h2-5H,12H2,1H3,(H,13,14)
InChIKeyNPJPRBZCAJOQES-UHFFFAOYSA-N
XLogP1.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(2-chloro-6-fluorophenyl)propanamide
CID 104877858
2-amino-N-(2-fluorophenyl)propanamide
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(2S)-2-amino-N-(4-bromo-2,6-difluorophenyl)propanamide
CID 79009037
2-amino-N-(2-fluorophenyl)propanamide;hydrochloride
CID 75973817
(2S)-2-amino-N-(3-fluoro-2-iodophenyl)propanamide
CID 130498725
2-amino-N-(2,6-dibromophenyl)propanamide
CID 12546848
2-(2-aminopropanoylamino)-6-fluorobenzoic acid
CID 61156859
2-amino-N-(2,6-difluorophenyl)hexanamide
CID 54928730
(2R)-2-amino-N-[1-(2,6-difluorophenyl)ethyl]propanamide;hydrochloride
CID 119285523
N-(2-amino-6-fluorophenyl)-2-methylbutanamide
CID 81314159
N-(2,6-difluorophenyl)-2-(2,3-dimethylphenoxy)propanamide
CID 43915329
(2R)-2-amino-N-(4-fluoro-1-methylbenzimidazol-2-yl)propanamide
CID 119338786

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,6-difluorophenyl)propanamide?
The IUPAC name of 2-amino-N-(2,6-difluorophenyl)propanamide (CID 43087644) is 2-amino-N-(2,6-difluorophenyl)propanamide.
What is the SMILES notation for 2-amino-N-(2,6-difluorophenyl)propanamide?
The canonical SMILES for 2-amino-N-(2,6-difluorophenyl)propanamide is CC(N)C(=O)Nc1c(F)cccc1F.
What is the InChIKey of 2-amino-N-(2,6-difluorophenyl)propanamide?
The InChIKey is NPJPRBZCAJOQES-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O/c1-5(12)9(14)13-8-6(10)3-2-4-7(8)11/h2-5H,12H2,1H3,(H,13,14).
What are the key properties of 2-amino-N-(2,6-difluorophenyl)propanamide?
2-amino-N-(2,6-difluorophenyl)propanamide has a molecular weight of 200.19 g/mol, XLogP of 1.25, 2 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)propanamide is sourced from PubChem (CID 43087644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).