N-(3-amino-2-fluorophenyl)acetamide

C8H9FN2O — CID 23022555

IUPACN-(3-amino-2-fluorophenyl)acetamide
SMILESCC(=O)Nc1cccc(N)c1F
InChIInChI=1S/C8H9FN2O/c1-5(12)11-7-4-2-3-6(10)8(7)9/h2-4H,10H2,1H3,(H,11,12)
InChIKeyDENWSTSHWFIZMZ-UHFFFAOYSA-N
MW168.17 g/mol
LogP1.37
Rot. Bonds1

About N-(3-amino-2-fluorophenyl)acetamide

N-(3-amino-2-fluorophenyl)acetamide (PubChem CID 23022555) has the molecular formula C8H9FN2O and a molecular weight of 168.17 g/mol. Its IUPAC name is N-(3-amino-2-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(3-amino-2-fluorophenyl)acetamide
PubChem CID23022555
Molecular FormulaC8H9FN2O
Molecular Weight168.17 g/mol
Exact Mass168.07
IUPAC NameN-(3-amino-2-fluorophenyl)acetamide
SMILESCC(=O)Nc1cccc(N)c1F
InChIInChI=1S/C8H9FN2O/c1-5(12)11-7-4-2-3-6(10)8(7)9/h2-4H,10H2,1H3,(H,11,12)
InChIKeyDENWSTSHWFIZMZ-UHFFFAOYSA-N
XLogP1.37
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

ethane;N-(2-fluoro-3-methylphenyl)acetamide
CID 145070564
N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide
CID 135260414
3-amino-2-fluorophenol;ethane
CID 155586440
N-(3-amino-2-fluorophenyl)-3-(2-cyanopropan-2-yl)benzamide
CID 137353668
N-[2-(2-acetamido-6-methylphenyl)-3-methylphenyl]acetamide
CID 22971546
N-[2-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide
CID 130046624
N-(2-amino-4-fluorophenyl)acetamide;ethane
CID 178102337
N-[3-amino-2-(cyclobutylamino)phenyl]acetamide
CID 154065884
N-(2,3,4-trifluoroquinolin-8-yl)acetamide
CID 20977696
2-acetamido-6-fluorobenzoate
CID 6933649
3-amino-2-chloro-N-(2,3-difluorophenyl)benzamide
CID 112575125
N-(3-amino-2-fluorophenyl)-1-methylcyclopropane-1-sulfonamide
CID 175844272

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-fluorophenyl)acetamide?
The IUPAC name of N-(3-amino-2-fluorophenyl)acetamide (CID 23022555) is N-(3-amino-2-fluorophenyl)acetamide.
What is the SMILES notation for N-(3-amino-2-fluorophenyl)acetamide?
The canonical SMILES for N-(3-amino-2-fluorophenyl)acetamide is CC(=O)Nc1cccc(N)c1F.
What is the InChIKey of N-(3-amino-2-fluorophenyl)acetamide?
The InChIKey is DENWSTSHWFIZMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN2O/c1-5(12)11-7-4-2-3-6(10)8(7)9/h2-4H,10H2,1H3,(H,11,12).
What are the key properties of N-(3-amino-2-fluorophenyl)acetamide?
N-(3-amino-2-fluorophenyl)acetamide has a molecular weight of 168.17 g/mol, XLogP of 1.37, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-fluorophenyl)acetamide is sourced from PubChem (CID 23022555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).