N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide

C13H16N4O3S2 — CID 8716246

IUPACN-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide
SMILES[H]/N=c1\sccn1CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C13H16N4O3S2/c1-16(2)22(19,20)11-5-3-4-10(8-11)15-12(18)9-17-6-7-21-13(17)14/h3-8,14H,9H2,1-2H3,(H,15,18)/b14-13-
InChIKeyZFQDZARQUZPSJT-YPKPFQOOSA-N
MW340.43 g/mol
LogP0.92
Rot. Bonds5

About N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide

N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide (PubChem CID 8716246) has the molecular formula C13H16N4O3S2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide
PubChem CID8716246
Molecular FormulaC13H16N4O3S2
Molecular Weight340.43 g/mol
Exact Mass340.07
IUPAC NameN-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide
SMILES[H]/N=c1\sccn1CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C13H16N4O3S2/c1-16(2)22(19,20)11-5-3-4-10(8-11)15-12(18)9-17-6-7-21-13(17)14/h3-8,14H,9H2,1-2H3,(H,15,18)/b14-13-
InChIKeyZFQDZARQUZPSJT-YPKPFQOOSA-N
XLogP0.92
TPSA95.26 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,4-dimethoxyphenyl)-2-(2-imino-1,3-thiazol-3-yl)acetamide
CID 4537458
2-(2-imino-1,3-thiazol-3-yl)-N-(4-phenoxyphenyl)acetamide
CID 3568385
N-[3-(dimethylsulfamoyl)phenyl]-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 51159788
2-cyclopentylsulfanyl-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 8763703
2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 9454413
N-[3-(dimethylsulfamoyl)phenyl]-2-(2-methylindol-1-yl)acetamide
CID 26689900
N-[3-(dimethylsulfamoyl)phenyl]-2-(6-methyl-4-oxoquinazolin-3-yl)acetamide
CID 55733302
4-amino-N-[3-(dimethylsulfamoyl)phenyl]butanamide
CID 43707686
N-(5-fluoro-2-methylphenyl)-2-(2-imino-1,3-thiazol-3-yl)acetamide
CID 2701258
2-cyclohexylsulfanyl-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 8705717
N-[4-(difluoromethylsulfanyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide chloride
CID 53351047
2-(2-imino-1,3-thiazol-3-yl)-N-(4-phenylmethoxyphenyl)acetamide
CID 2608047

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide?
The IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide (CID 8716246) is N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide.
What is the SMILES notation for N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide?
The canonical SMILES for N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide is [H]/N=c1\sccn1CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1.
What is the InChIKey of N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide?
The InChIKey is ZFQDZARQUZPSJT-YPKPFQOOSA-N. The full InChI is InChI=1S/C13H16N4O3S2/c1-16(2)22(19,20)11-5-3-4-10(8-11)15-12(18)9-17-6-7-21-13(17)14/h3-8,14H,9H2,1-2H3,(H,15,18)/b14-13-.
What are the key properties of N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide?
N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide has a molecular weight of 340.43 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylsulfamoyl)phenyl]-2-(2-imino-1,3-thiazol-3-yl)acetamide is sourced from PubChem (CID 8716246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).