2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide

C14H12ClFN2O2S — CID 81192638

IUPAC2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide
SMILESNc1ccc(F)cc1S(=O)CC(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H12ClFN2O2S/c15-10-3-1-2-4-12(10)18-14(19)8-21(20)13-7-9(16)5-6-11(13)17/h1-7H,8,17H2,(H,18,19)
InChIKeyYJIGESBXBOFYFT-UHFFFAOYSA-N
MW326.78 g/mol
LogP2.81
Rot. Bonds4

About 2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide

2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide (PubChem CID 81192638) has the molecular formula C14H12ClFN2O2S and a molecular weight of 326.78 g/mol. Its IUPAC name is 2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide
PubChem CID81192638
Molecular FormulaC14H12ClFN2O2S
Molecular Weight326.78 g/mol
Exact Mass326.03
IUPAC Name2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide
SMILESNc1ccc(F)cc1S(=O)CC(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H12ClFN2O2S/c15-10-3-1-2-4-12(10)18-14(19)8-21(20)13-7-9(16)5-6-11(13)17/h1-7H,8,17H2,(H,18,19)
InChIKeyYJIGESBXBOFYFT-UHFFFAOYSA-N
XLogP2.81
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.78
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide
CID 81201202
2-(2-amino-5-fluorophenyl)sulfinyl-N-(3-methylbutyl)acetamide
CID 81182738
N-(2-chlorophenyl)-2-[(S)-(3-chlorophenyl)sulfinyl]acetamide
CID 40520627
N-(2-amino-5-fluorophenyl)-2-thiophen-2-ylsulfinylacetamide
CID 61304641
N-(2-amino-4-chlorophenyl)-2-(4-fluorophenyl)sulfinylacetamide
CID 61301818
2-(2-amino-4-chlorophenyl)sulfinyl-N-(2-methylphenyl)acetamide
CID 81176455
N-(5-amino-2-chlorophenyl)-2-(2-bromophenyl)sulfinylacetamide
CID 61287005
2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-methylphenyl)acetamide
CID 81202410
2-(2-amino-6-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide
CID 81185788
N-(2-chlorophenyl)-2-(2,4-difluorophenoxy)acetamide
CID 31854987
2-(2-amino-5-chlorophenyl)sulfinyl-N-methylacetamide
CID 81180842
2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide
CID 81186906

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide?
The IUPAC name of 2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide (CID 81192638) is 2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide.
What is the SMILES notation for 2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide?
The canonical SMILES for 2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide is Nc1ccc(F)cc1S(=O)CC(=O)Nc1ccccc1Cl.
What is the InChIKey of 2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide?
The InChIKey is YJIGESBXBOFYFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClFN2O2S/c15-10-3-1-2-4-12(10)18-14(19)8-21(20)13-7-9(16)5-6-11(13)17/h1-7H,8,17H2,(H,18,19).
What are the key properties of 2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide?
2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide has a molecular weight of 326.78 g/mol, XLogP of 2.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide is sourced from PubChem (CID 81192638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).